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1,3-dimethyl 2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate

Flow Object IDfo-8609c8cd635b3f7b
TypeConsensus
prefLabel
Label Language
1,3-dimethyl 2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate en
Alt Labels
Label Language Provenance
1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate en —
Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate en —
Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester en —
Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester en —
CAS Numbers172529-93-0
EC Numbers605-637-3
Changes Applied26

Properties

Predicate Value
InChIKey IBZRPQPXPGRKSX-UHFFFAOYSA-N, SALNWJHEVGXTER-UHFFFAOYSA-N
InChI InChI=1S/C12H14ClN5O4/c1-21-10(19)6(11(20)22-2)3-4-18-5-15-7-8(13)16-12(14)17-9(7)18/h5-6H,3-4H2,1-2H3,(H2,14,16,17), InChI=1S/C12H14ClN5O4/c1-4-12(9(19)21-2,10(20)22-3)18-5-15-6-7(13)16-11(14)17-8(6)18/h5H,4H2,1-3H3,(H2,14,16,17)
IUPAC name 2-(2-amino-6-chloro-9-purinyl)-2-ethylpropanedioic acid dimethyl ester, 2-(2-amino-6-chloro-purin-9-yl)-2-ethyl-malonic acid dimethyl ester, 2-[2-(2-amino-6-chloro-9-purinyl)ethyl]propanedioic acid dimethyl ester, 2-[2-(2-amino-6-chloro-purin-9-yl)ethyl]malonic acid dimethyl ester, dimethyl 2-(2-amino-6-chloro-purin-9-yl)-2-ethyl-propanedioate, dimethyl 2-(2-amino-6-chloropurin-9-yl)-2-ethylpropanedioate, dimethyl 2-(2-azanyl-6-chloranyl-purin-9-yl)-2-ethyl-propanedioate, dimethyl 2-[2-(2-amino-6-chloro-purin-9-yl)ethyl]propanedioate, dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]propanedioate, dimethyl 2-[2-(2-azanyl-6-chloranyl-purin-9-yl)ethyl]propanedioate
Molecular formula C12H14ClN5O4
SMILES CCC(C(=O)OC)(C(=O)OC)N1C=NC2=C1N=C(N=C2Cl)N, COC(=O)C(CCN1C=NC2=C1N=C(N=C2Cl)N)C(=O)OC

References

Linked Elementary Flows

UUID Source Unit Context LCIA Factors Consensus Changes
a23a7fdf… EF 3.1 kg Environmental → Air → Aircraft cruise height 2 2
406e5332… EF 3.1 kg Environmental → Air → Ground level → Rural (<1000 people/square mile) 0 2
a4d8be0b… EF 3.1 kg Environmental → Air → Ground level → Urban (>1000 people/square mile) 2 2
8f5a8c90… EF 3.1 kg Environmental → Air → High stack, >150 meters 2 2
541c6058… EF 3.1 kg Environmental → Air → Unknown 2 2
8fdc015a… EF 3.1 kg Environmental → Air → Unknown 2 2
dccfed7a… EF 3.1 kg Environmental → Ground → Agricultural 2 2
5088eb69… EF 3.1 kg Environmental → Ground → Unknown 2 2
0f64d05a… EF 3.1 kg Environmental → Water → Ocean 2 2
33fcf0a7… EF 3.1 kg Environmental → Water → Surface water 2 2
7917290d… EF 3.1 kg Environmental → Water → Unknown 2 2
▶

Changes Applied
Elementary Flow Field Old Value New Value Comment
0f64d05a… altLabel — [{"@value":"1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; cas=172529-93-0; added Common Chemistry CAS names as altLabel: 1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate, Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate, Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester, Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester; object_uuid=fo-8609c8cd635b3f7b
0f64d05a… cas_match_labels — {"172529-93-0":"exactMatch"} group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['pubchem']; cas_sources={'172529-93-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8609c8cd635b3f7b: {'172529-93-0': 'exactMatch'}
30c56dd6… altLabel — [{"@value":"1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; cas=172529-93-0; added Common Chemistry CAS names as altLabel: 1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate, Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate, Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester, Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester; object_uuid=fo-8609c8cd635b3f7b
30c56dd6… cas_match_labels — {"172529-93-0":"exactMatch"} group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['pubchem']; cas_sources={'172529-93-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8609c8cd635b3f7b: {'172529-93-0': 'exactMatch'}
33fcf0a7… altLabel — [{"@value":"1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; cas=172529-93-0; added Common Chemistry CAS names as altLabel: 1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate, Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate, Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester, Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester; object_uuid=fo-8609c8cd635b3f7b
33fcf0a7… cas_match_labels — {"172529-93-0":"exactMatch"} group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['pubchem']; cas_sources={'172529-93-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8609c8cd635b3f7b: {'172529-93-0': 'exactMatch'}
406e5332… altLabel — [{"@value":"1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; cas=172529-93-0; added Common Chemistry CAS names as altLabel: 1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate, Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate, Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester, Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester; object_uuid=fo-8609c8cd635b3f7b
406e5332… cas_match_labels — {"172529-93-0":"exactMatch"} group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['pubchem']; cas_sources={'172529-93-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8609c8cd635b3f7b: {'172529-93-0': 'exactMatch'}
5088eb69… altLabel — [{"@value":"1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; cas=172529-93-0; added Common Chemistry CAS names as altLabel: 1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate, Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate, Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester, Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester; object_uuid=fo-8609c8cd635b3f7b
5088eb69… cas_match_labels — {"172529-93-0":"exactMatch"} group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['pubchem']; cas_sources={'172529-93-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8609c8cd635b3f7b: {'172529-93-0': 'exactMatch'}
541c6058… altLabel — [{"@value":"1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; cas=172529-93-0; added Common Chemistry CAS names as altLabel: 1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate, Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate, Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester, Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester; object_uuid=fo-8609c8cd635b3f7b
541c6058… cas_match_labels — {"172529-93-0":"exactMatch"} group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['pubchem']; cas_sources={'172529-93-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8609c8cd635b3f7b: {'172529-93-0': 'exactMatch'}
7183d042… altLabel — [{"@value":"1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; cas=172529-93-0; added Common Chemistry CAS names as altLabel: 1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate, Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate, Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester, Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester; object_uuid=fo-8609c8cd635b3f7b
7183d042… cas_match_labels — {"172529-93-0":"exactMatch"} group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['pubchem']; cas_sources={'172529-93-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8609c8cd635b3f7b: {'172529-93-0': 'exactMatch'}
7917290d… altLabel — [{"@value":"1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; cas=172529-93-0; added Common Chemistry CAS names as altLabel: 1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate, Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate, Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester, Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester; object_uuid=fo-8609c8cd635b3f7b
7917290d… cas_match_labels — {"172529-93-0":"exactMatch"} group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['pubchem']; cas_sources={'172529-93-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8609c8cd635b3f7b: {'172529-93-0': 'exactMatch'}
8f5a8c90… altLabel — [{"@value":"1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; cas=172529-93-0; added Common Chemistry CAS names as altLabel: 1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate, Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate, Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester, Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester; object_uuid=fo-8609c8cd635b3f7b
8f5a8c90… cas_match_labels — {"172529-93-0":"exactMatch"} group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['pubchem']; cas_sources={'172529-93-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8609c8cd635b3f7b: {'172529-93-0': 'exactMatch'}
8fdc015a… altLabel — [{"@value":"1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; cas=172529-93-0; added Common Chemistry CAS names as altLabel: 1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate, Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate, Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester, Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester; object_uuid=fo-8609c8cd635b3f7b
8fdc015a… cas_match_labels — {"172529-93-0":"exactMatch"} group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['pubchem']; cas_sources={'172529-93-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8609c8cd635b3f7b: {'172529-93-0': 'exactMatch'}
a23a7fdf… altLabel — [{"@value":"1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; cas=172529-93-0; added Common Chemistry CAS names as altLabel: 1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate, Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate, Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester, Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester; object_uuid=fo-8609c8cd635b3f7b
a23a7fdf… cas_match_labels — {"172529-93-0":"exactMatch"} group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['pubchem']; cas_sources={'172529-93-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8609c8cd635b3f7b: {'172529-93-0': 'exactMatch'}
a4d8be0b… altLabel — [{"@value":"1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; cas=172529-93-0; added Common Chemistry CAS names as altLabel: 1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate, Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate, Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester, Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester; object_uuid=fo-8609c8cd635b3f7b
a4d8be0b… cas_match_labels — {"172529-93-0":"exactMatch"} group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['pubchem']; cas_sources={'172529-93-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8609c8cd635b3f7b: {'172529-93-0': 'exactMatch'}
dccfed7a… altLabel — [{"@value":"1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:172529-93-0","https://commonchemistry.cas.org/detail?cas_rn=172529-93-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; cas=172529-93-0; added Common Chemistry CAS names as altLabel: 1,3-Dimethyl 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]propanedioate, Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate, Propanedioic acid, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-dimethyl ester, Propanedioic acid, [2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, dimethyl ester; object_uuid=fo-8609c8cd635b3f7b
dccfed7a… cas_match_labels — {"172529-93-0":"exactMatch"} group_key=1,3-dimethyl2-[2-(2-amino-6-chloro-9h-purin-9-yl)ethyl]propanedioate||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['pubchem']; cas_sources={'172529-93-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8609c8cd635b3f7b: {'172529-93-0': 'exactMatch'}

Flow Object JSON

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  "properties": {
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      "rdfs:label": "Molecular formula",
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