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Retrorsine

UUID 8955b3af-0441-4410-bf2f-4ecea0ce4d13
Deprecated yes
Replaced By 11bc94ef-2a70-4526-a56d-b7b6fd0b6eeb
Flow Object IDfo-8a02e72cb20902fc
Source EF 3.1
Context Environmental → Ground → Unknown
CAS Numbers 480-54-6
prefLabel
Language Value Provenance
en Retrorsine
altLabel
Language Value Provenance
en (3<em>Z</em>,5<em>R</em>,6<em>S</em>,14a<em>R</em>,14b<em>R</em>)-3-Ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-6-(hydroxymethyl)-5-methyl[1,6]dioxacyclododecino[2,3,4-<em>gh</em>]pyrrolizine-2,7-dione
en NSC 107659
en Retrorsin
en Senecionan-11,16-dione, 12,18-dihydroxy-
en [1,6]Dioxacyclododecino[2,3,4-<em>gh</em>]pyrrolizine-2,7-dione, 3-ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-6-(hydroxymethyl)-5-methyl-, (3<em>Z</em>,5<em>R</em>,6<em>S</em>,14a<em>R</em>,14b<em>R</em>)-
en [1,6]Dioxacyclododecino[2,3,4-<em>gh</em>]pyrrolizine-2,7-dione, 3-ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-6-(hydroxymethyl)-5-methyl-, [5<em>R</em>-(3<em>Z</em>,5<em>R</em>*,6<em>S</em>*,14a<em>R</em>*,14b<em>R</em>*)]-
en β-Longilobine
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey BCJMNZRQJAVDLD-CQRYIUNCSA-N
InChI InChI=1S/C18H25NO6/c1-3-12-8-11(2)18(23,10-20)17(22)24-9-13-4-6-19-7-5-14(15(13)19)25-16(12)21/h3-4,11,14-15,20,23H,5-10H2,1-2H3/b12-3-/t11-,14-,15-,18-/m1/s1
IUPAC name (1R,4Z,6R,7S,17R)-4-ethylidene-7-(hydroxymethyl)-6-methyl-7-oxidanyl-2,9-dioxa-14-azatricyclo[9.5.1.014,17]heptadec-11-ene-3,8-dione, (1R,4Z,6R,7S,17R)-4-ethylidene-7-hydroxy-6-methyl-7-methylol-2,9-dioxa-14-azatricyclo[9.5.1.014,17]heptadec-11-ene-3,8-quinone, (1R,4Z,6R,7S,17R)-4-ethylidene-7-hydroxy-7-(hydroxymethyl)-6-methyl-2,9-dioxa-14-azatricyclo[9.5.1.014,17]heptadec-11-ene-3,8-dione
Molecular formula C18H25NO6
Molecular mass 351.399
Monoisotopic mass 351.16819
SMILES C/C=C\1/C[C@H]([C@@](C(=O)OCC2=CCN3[C@H]2[C@@H](CC3)OC1=O)(CO)O)C, CC=C1CC(C(C(=O)OCC2=CCN3C2C(CC3)OC1=O)(CO)O)C, [H][C@]12C3=CCN1CC[C@H]2OC(=O)/C(=CC)C[C@@H](C)[C@](O)(CO)C(=O)OC3

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 8955b3af-0441-4410-bf2f-4ecea0ce4d13 retrorsine

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=retrorsine||dimension=Environmental > media=Water > water_body=Unknown; cas=480-54-6; added Common Chemistry CAS names as altLabel: (3<em>Z</em>,5<em>R</em>,6<em>S</em>,14a<em>R</em>,14b<em>R</em>)-3-Ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-6-(hydroxymethyl)-5-methyl[1,6]dioxacyclododecino[2,3,4-<em>gh</em>]pyrrolizine-2,7-dione, NSC 107659, Retrorsin, Senecionan-11,16-dione, 12,18-dihydroxy-, [1,6]Dioxacyclododecino[2,3,4-<em>gh</em>]pyrrolizine-2,7-dione, 3-ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-6-(hydroxymethyl)-5-methyl-, (3<em>Z</em>,5<em>R</em>,6<em>S</em>,14a<em>R</em>,14b<em>R</em>)-, [1,6]Dioxacyclododecino[2,3,4-<em>gh</em>]pyrrolizine-2,7-dione, 3-ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-6-(hydroxymethyl)-5-methyl-, [5<em>R</em>-(3<em>Z</em>,5<em>R</em>*,6<em>S</em>*,14a<em>R</em>*,14b<em>R</em>*)]-, β-Longilobine; object_uuid=fo-8a02e72cb20902fc
cas_match_labels 1 consensus_match group_key=retrorsine||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'pubchem']; cas_sources={'480-54-6': ['chebi', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8a02e72cb20902fc: {'480-54-6': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
geographyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '(3<em>Z</em>,5<em>R</em>,6<em>S</em>,14a<em>R</em>,14b<em>R</em>)-3-Ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-6-(hydroxymethyl)-5-methyl[1,6]dioxacyclododecino[2,3,4-<em>gh</em>]pyrrolizine-2,7-dione', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:480-54-6', 'https://commonchemistry.cas.org/detail?cas_rn=480-54-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 107659', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:480-54-6', 'https://commonchemistry.cas.org/detail?cas_rn=480-54-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Retrorsin', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:480-54-6', 'https://commonchemistry.cas.org/detail?cas_rn=480-54-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Senecionan-11,16-dione, 12,18-dihydroxy-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:480-54-6', 'https://commonchemistry.cas.org/detail?cas_rn=480-54-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '[1,6]Dioxacyclododecino[2,3,4-<em>gh</em>]pyrrolizine-2,7-dione, 3-ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-6-(hydroxymethyl)-5-methyl-, (3<em>Z</em>,5<em>R</em>,6<em>S</em>,14a<em>R</em>,14b<em>R</em>)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:480-54-6', 'https://commonchemistry.cas.org/detail?cas_rn=480-54-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '[1,6]Dioxacyclododecino[2,3,4-<em>gh</em>]pyrrolizine-2,7-dione, 3-ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-6-(hydroxymethyl)-5-methyl-, [5<em>R</em>-(3<em>Z</em>,5<em>R</em>*,6<em>S</em>*,14a<em>R</em>*,14b<em>R</em>*)]-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:480-54-6', 'https://commonchemistry.cas.org/detail?cas_rn=480-54-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'β-Longilobine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:480-54-6', 'https://commonchemistry.cas.org/detail?cas_rn=480-54-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=retrorsine||dimension=Environmental > media=Water > water_body=Unknown; cas=480-54-6; added Common Chemistry CAS names as altLabel: (3<em>Z</em>,5<em>R</em>,6<em>S</em>,14a<em>R</em>,14b<em>R</em>)-3-Ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-6-(hydroxymethyl)-5-methyl[1,6]dioxacyclododecino[2,3,4-<em>gh</em>]pyrrolizine-2,7-dione, NSC 107659, Retrorsin, Senecionan-11,16-dione, 12,18-dihydroxy-, [1,6]Dioxacyclododecino[2,3,4-<em>gh</em>]pyrrolizine-2,7-dione, 3-ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-6-(hydroxymethyl)-5-methyl-, (3<em>Z</em>,5<em>R</em>,6<em>S</em>,14a<em>R</em>,14b<em>R</em>)-, [1,6]Dioxacyclododecino[2,3,4-<em>gh</em>]pyrrolizine-2,7-dione, 3-ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-6-(hydroxymethyl)-5-methyl-, [5<em>R</em>-(3<em>Z</em>,5<em>R</em>*,6<em>S</em>*,14a<em>R</em>*,14b<em>R</em>*)]-, β-Longilobine; object_uuid=fo-8a02e72cb20902fc
cas_match_labels None {'480-54-6': 'exactMatch'} group_key=retrorsine||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'pubchem']; cas_sources={'480-54-6': ['chebi', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8a02e72cb20902fc: {'480-54-6': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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