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Senkirkine

UUID fe0acd60-3ddc-11dd-a1df-0050c2490048
Deprecated yes
Replaced By fe0acd60-3ddc-11dd-a1de-0050c2490048
Flow Object IDfo-f6ec67f1cb501ffd
Source EF 3.1
Context Environmental → Water → Unknown
CAS Numbers 2318-18-5
prefLabel
Language Value Provenance
en Senkirkine
altLabel ⓘ
Language Value Provenance
en Renardine
en (1<em>R</em>,4<em>Z</em>,6<em>R</em>,7<em>R</em>)-4-Ethylidene-7-hydroxy-6,7,14-trimethyl-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione
en 2,3,5,7a-Tetrahydro-1,7a-dihydroxy-7-(hydroxymethyl)-4-methyl-1<em>H</em>-pyrrolizinium hydroxide, inner salt, cyclic diester with senecic acid
en 2,9-Dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione, 4-ethylidene-7-hydroxy-6,7,14-trimethyl-, (1<em>R</em>,4<em>Z</em>,6<em>R</em>,7<em>R</em>)-
en 2,9-Dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione, 4-ethylidene-7-hydroxy-6,7,14-trimethyl-, [1<em>R</em>-(1<em>R</em>*,4<em>Z</em>,6<em>R</em>*,7<em>R</em>*)]-
en 4,8-Secosenecionan-8,11,16-trione, 12-hydroxy-4-methyl-
en NSC 89945
en Renardin
en Renardine (neutral)
en Senkirkin
en Senkirkine (neutral)
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey HPDHKHMHQGCNPE-QLJRNOHWSA-N
InChI InChI=1S/C19H27NO6/c1-5-13-10-12(2)19(3,24)18(23)25-11-14-6-8-20(4)9-7-15(16(14)21)26-17(13)22/h5-6,12,15,24H,7-11H2,1-4H3/b13-5-,14-6-/t12-,15-,19-/m1/s1
IUPAC name (1R,4Z,6R,7R,11Z)-4-ethylidene-6,7,14-trimethyl-7-oxidanyl-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione, (1R,4Z,6R,7R,11Z)-4-ethylidene-7-hydroxy-6,7,14-trimethyl-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione
Molecular formula C19H27NO6
Molecular mass 365.426
Monoisotopic mass 365.18384
SMILES C/C=C1/C[C@@H](C)[C@@](C)(O)C(=O)OC/C2=C/CN(C)CC[C@@H](OC1=O)C2=O, C/C=C\1/C[C@H]([C@@](C(=O)OC/C/2=C/CN(CC[C@H](C2=O)OC1=O)C)(C)O)C, CC=C1CC(C(C(=O)OCC2=CCN(CCC(C2=O)OC1=O)C)(C)O)C

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 fe0acd60-3ddc-11dd-a1df-0050c2490048 senkirkine

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=senkirkine||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=2318-18-5; added Common Chemistry CAS names as altLabel: (1<em>R</em>,4<em>Z</em>,6<em>R</em>,7<em>R</em>)-4-Ethylidene-7-hydroxy-6,7,14-trimethyl-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione, 2,3,5,7a-Tetrahydro-1,7a-dihydroxy-7-(hydroxymethyl)-4-methyl-1<em>H</em>-pyrrolizinium hydroxide, inner salt, cyclic diester with senecic acid, 2,9-Dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione, 4-ethylidene-7-hydroxy-6,7,14-trimethyl-, (1<em>R</em>,4<em>Z</em>,6<em>R</em>,7<em>R</em>)-, 2,9-Dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione, 4-ethylidene-7-hydroxy-6,7,14-trimethyl-, [1<em>R</em>-(1<em>R</em>*,4<em>Z</em>,6<em>R</em>*,7<em>R</em>*)]-, 4,8-Secosenecionan-8,11,16-trione, 12-hydroxy-4-methyl-, NSC 89945, Renardin, Renardine (neutral), Senkirkin, Senkirkine (neutral); object_uuid=fo-f6ec67f1cb501ffd
cas_match_labels 1 — consensus_match group_key=senkirkine||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'pubchem']; cas_sources={'2318-18-5': ['chebi', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f6ec67f1cb501ffd: {'2318-18-5': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel [{'@value': 'Renardine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Renardine', 'http://purl.obolibrary.org/obo/CHEBI_9111', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': 'Renardine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Renardine', 'http://purl.obolibrary.org/obo/CHEBI_9111', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(1<em>R</em>,4<em>Z</em>,6<em>R</em>,7<em>R</em>)-4-Ethylidene-7-hydroxy-6,7,14-trimethyl-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2318-18-5', 'https://commonchemistry.cas.org/detail?cas_rn=2318-18-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2,3,5,7a-Tetrahydro-1,7a-dihydroxy-7-(hydroxymethyl)-4-methyl-1<em>H</em>-pyrrolizinium hydroxide, inner salt, cyclic diester with senecic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2318-18-5', 'https://commonchemistry.cas.org/detail?cas_rn=2318-18-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2,9-Dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione, 4-ethylidene-7-hydroxy-6,7,14-trimethyl-, (1<em>R</em>,4<em>Z</em>,6<em>R</em>,7<em>R</em>)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2318-18-5', 'https://commonchemistry.cas.org/detail?cas_rn=2318-18-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2,9-Dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione, 4-ethylidene-7-hydroxy-6,7,14-trimethyl-, [1<em>R</em>-(1<em>R</em>*,4<em>Z</em>,6<em>R</em>*,7<em>R</em>*)]-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2318-18-5', 'https://commonchemistry.cas.org/detail?cas_rn=2318-18-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '4,8-Secosenecionan-8,11,16-trione, 12-hydroxy-4-methyl-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2318-18-5', 'https://commonchemistry.cas.org/detail?cas_rn=2318-18-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 89945', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2318-18-5', 'https://commonchemistry.cas.org/detail?cas_rn=2318-18-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Renardin', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2318-18-5', 'https://commonchemistry.cas.org/detail?cas_rn=2318-18-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Renardine (neutral)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2318-18-5', 'https://commonchemistry.cas.org/detail?cas_rn=2318-18-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Senkirkin', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2318-18-5', 'https://commonchemistry.cas.org/detail?cas_rn=2318-18-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Senkirkine (neutral)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2318-18-5', 'https://commonchemistry.cas.org/detail?cas_rn=2318-18-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=senkirkine||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=2318-18-5; added Common Chemistry CAS names as altLabel: (1<em>R</em>,4<em>Z</em>,6<em>R</em>,7<em>R</em>)-4-Ethylidene-7-hydroxy-6,7,14-trimethyl-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione, 2,3,5,7a-Tetrahydro-1,7a-dihydroxy-7-(hydroxymethyl)-4-methyl-1<em>H</em>-pyrrolizinium hydroxide, inner salt, cyclic diester with senecic acid, 2,9-Dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione, 4-ethylidene-7-hydroxy-6,7,14-trimethyl-, (1<em>R</em>,4<em>Z</em>,6<em>R</em>,7<em>R</em>)-, 2,9-Dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione, 4-ethylidene-7-hydroxy-6,7,14-trimethyl-, [1<em>R</em>-(1<em>R</em>*,4<em>Z</em>,6<em>R</em>*,7<em>R</em>*)]-, 4,8-Secosenecionan-8,11,16-trione, 12-hydroxy-4-methyl-, NSC 89945, Renardin, Renardine (neutral), Senkirkin, Senkirkine (neutral); object_uuid=fo-f6ec67f1cb501ffd
cas_match_labels None {'2318-18-5': 'exactMatch'} group_key=senkirkine||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'pubchem']; cas_sources={'2318-18-5': ['chebi', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f6ec67f1cb501ffd: {'2318-18-5': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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