6-Chloro famciclovir

← Back to consensus flows

UUID a4a7694e-bc06-4e93-aba9-0f300be133fc

Flow Object ID fo-a96e58f55458a177

Source EF 3.1

Context Environmental → Air → Aircraft cruise height

CAS Numbers 97845-60-8

EC Numbers 619-293-7

prefLabel

Language	Value	Provenance
`en`	`6-Chloro famciclovir`

altLabel ⓘ

Language	Value	Provenance
`en`	`1,1′-[2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-1,3-propanediyl] diacetate`
`en`	`1,3-Propanediol, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-diacetate`
`en`	`1,3-Propanediol, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, diacetate (ester)`
`en`	`2-Amino-6-chloro-9-(4-acetoxy-3-acetoxymethylbutyl)purine`
`en`	`9-[4-Acetoxy-3-(acetoxymethyl)butyl]-2-amino-6-chloropurine`
`en`	`[2-(Acetyloxymethyl)-4-(2-amino-6-chloropurin-9-yl)butyl] acetate`
`en`	`2-[(acetyloxy)methyl]-4-(2-amino-6-chloro-9h-purin-9-yl)butyl Acetate`

References

Shared Properties

Predicate	Value
InChIKey	`KXPSHSVVYGZKAV-UHFFFAOYSA-N`
InChI	`InChI=1S/C14H18ClN5O4/c1-8(21)23-5-10(6-24-9(2)22)3-4-20-7-17-11-12(15)18-14(16)19-13(11)20/h7,10H,3-6H2,1-2H3,(H2,16,18,19)`
IUPAC name	`[2-(acetoxymethyl)-4-(2-amino-6-chloro-purin-9-yl)butyl] acetate, [2-(acetyloxymethyl)-4-(2-amino-6-chloropurin-9-yl)butyl] acetate, [2-(acetyloxymethyl)-4-(2-azanyl-6-chloranyl-purin-9-yl)butyl] ethanoate, acetic acid [2-(acetoxymethyl)-4-(2-amino-6-chloro-purin-9-yl)butyl] ester, acetic acid [2-(acetyloxymethyl)-4-(2-amino-6-chloro-9-purinyl)butyl] ester`
Molecular formula	`C14H18ClN5O4`
SMILES	`CC(=O)OCC(CCN1C=NC2=C1N=C(N=C2Cl)N)COC(=O)C`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`a4a7694e-bc06-4e93-aba9-0f300be133fc`	2-[(acetyloxy)methyl]-4-(2-amino-6-chloro-9h-purin-9-yl)butyl acetate

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	2-[(acetyloxy)methyl]-4-(2-amino-6-chloro-9h-purin-9-yl)butyl acetate	Emissions/Emissions to air/Emissions to lower stratosphere and upper troposphere	kg	`exactMatch`	—

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field	Change Count	Latest Time	Transformers	Latest Comment
`altLabel`	1	`—`	consensus_match	group_key=2-[(acetyloxy)methyl]-4-(2-amino-6-chloro-9h-purin-9-yl)butylacetate\|\|dimension=Environmental > media=Air > indoor=Unknown; cas=97845-60-8; added Common Chemistry CAS names as altLabel: 1,1′-[2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-1,3-propanediyl] diacetate, 1,3-Propanediol, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-diacetate, 1,3-Propanediol, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, diacetate (ester), 2-Amino-6-chloro-9-(4-acetoxy-3-acetoxymethylbutyl)purine, 9-[4-Acetoxy-3-(acetoxymethyl)butyl]-2-amino-6-chloropurine, [2-(Acetyloxymethyl)-4-(2-amino-6-chloropurin-9-yl)butyl] acetate; object_uuid=fo-a96e58f55458a177
`cas_match_labels`	1	`—`	consensus_match	group_key=2-[(acetyloxy)methyl]-4-(2-amino-6-chloro-9h-purin-9-yl)butylacetate\|\|dimension=Environmental > media=Air > indoor=Unknown; group_sources=['pubchem']; cas_sources={'97845-60-8': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a96e58f55458a177: {'97845-60-8': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Air
strata	Aircraft cruise height

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`None`	[{'@value': '1,1′-[2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-1,3-propanediyl] diacetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:97845-60-8', 'https://commonchemistry.cas.org/detail?cas_rn=97845-60-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,3-Propanediol, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-diacetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:97845-60-8', 'https://commonchemistry.cas.org/detail?cas_rn=97845-60-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,3-Propanediol, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, diacetate (ester)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:97845-60-8', 'https://commonchemistry.cas.org/detail?cas_rn=97845-60-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Amino-6-chloro-9-(4-acetoxy-3-acetoxymethylbutyl)purine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:97845-60-8', 'https://commonchemistry.cas.org/detail?cas_rn=97845-60-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '9-[4-Acetoxy-3-(acetoxymethyl)butyl]-2-amino-6-chloropurine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:97845-60-8', 'https://commonchemistry.cas.org/detail?cas_rn=97845-60-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '[2-(Acetyloxymethyl)-4-(2-amino-6-chloropurin-9-yl)butyl] acetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:97845-60-8', 'https://commonchemistry.cas.org/detail?cas_rn=97845-60-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=2-[(acetyloxy)methyl]-4-(2-amino-6-chloro-9h-purin-9-yl)butylacetate\|\|dimension=Environmental > media=Air > indoor=Unknown; cas=97845-60-8; added Common Chemistry CAS names as altLabel: 1,1′-[2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-1,3-propanediyl] diacetate, 1,3-Propanediol, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, 1,3-diacetate, 1,3-Propanediol, 2-[2-(2-amino-6-chloro-9<em>H</em>-purin-9-yl)ethyl]-, diacetate (ester), 2-Amino-6-chloro-9-(4-acetoxy-3-acetoxymethylbutyl)purine, 9-[4-Acetoxy-3-(acetoxymethyl)butyl]-2-amino-6-chloropurine, [2-(Acetyloxymethyl)-4-(2-amino-6-chloropurin-9-yl)butyl] acetate; object_uuid=fo-a96e58f55458a177
`cas_match_labels`	`None`	`{'97845-60-8': 'exactMatch'}`	group_key=2-[(acetyloxy)methyl]-4-(2-amino-6-chloro-9h-purin-9-yl)butylacetate\|\|dimension=Environmental > media=Air > indoor=Unknown; group_sources=['pubchem']; cas_sources={'97845-60-8': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a96e58f55458a177: {'97845-60-8': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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