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Jasmolin I

UUID 7c137744-8ad1-4c09-a54d-300ec2740dfe
Deprecated yes
Replaced By e17c4c78-44ad-4b30-9b09-d4e0d269fa8b
Flow Object IDfo-eb974a29caf6315e
Source EF 3.1
Context Environmental → Water → Unknown
CAS Numbers 4466-14-2
EC Numbers 232-319-8
prefLabel
Language Value Provenance
en Jasmolin I
altLabel ⓘ
Language Value Provenance
en (1S)-2-methyl-4-oxo-3-[(2Z)-pent-2-en-1-yl]cyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate
en (-)-Jasmolin I
en Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-, (1<em>S</em>)-2-methyl-4-oxo-3-(2<em>Z</em>)-2-penten-1-yl-2-cyclopenten-1-yl ester, (1<em>R</em>,3<em>R</em>)-
en Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, (1<em>S</em>)-2-methyl-4-oxo-3-(2<em>Z</em>)-2-pentenyl-2-cyclopenten-1-yl ester, (1<em>R</em>,3<em>R</em>)-
en Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, 2-methyl-4-oxo-3-(2-pentenyl)-2-cyclopenten-1-yl ester, [1<em>R</em>-[1α[<em>S</em>*(<em>Z</em>)],3β]]-
en Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methylpropenyl)-, ester with 4-hydroxy-3-methyl-2-(2-pentenyl)-2-cyclopenten-1-one
en Jasmoline I
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey NZKIRHFOLVYKFT-VUMXUWRFSA-N
InChI InChI=1S/C21H30O3/c1-7-8-9-10-15-14(4)18(12-17(15)22)24-20(23)19-16(11-13(2)3)21(19,5)6/h8-9,11,16,18-19H,7,10,12H2,1-6H3/b9-8-/t16-,18+,19+/m1/s1
IUPAC name cis-(1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)-1-cyclopropanecarboxylic acid [(1S)-2-methyl-4-oxo-3-[(Z)-pent-2-enyl]-1-cyclopent-2-enyl] ester, cis-(1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylic acid [(1S)-4-keto-2-methyl-3-[(Z)-pent-2-enyl]cyclopent-2-en-1-yl] ester, cis-[(1S)-2-methyl-4-oxidanylidene-3-[(Z)-pent-2-enyl]cyclopent-2-en-1-yl] (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate, cis-[(1S)-2-methyl-4-oxo-3-[(Z)-pent-2-enyl]cyclopent-2-en-1-yl] (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate, cis-[(1S)-2-methyl-4-oxo-3-[(Z)-pent-2-enyl]cyclopent-2-en-1-yl] (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylate
Molecular formula C21H30O3
Molecular mass 330.468
Monoisotopic mass 330.21949
SMILES CC/C=CCC1=C(C)[C@@H](OC(=O)[C@@H]2[C@@H](C=C(C)C)C2(C)C)CC1=O, CC/C=C\CC1=C([C@H](CC1=O)OC(=O)[C@@H]2[C@H](C2(C)C)C=C(C)C)C, CCC=CCC1=C(C(CC1=O)OC(=O)C2C(C2(C)C)C=C(C)C)C

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 7c137744-8ad1-4c09-a54d-300ec2740dfe jasmolin i

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=jasmolini||dimension=Environmental > media=Ground > geography=Unknown; cas=4466-14-2; added Common Chemistry CAS names as altLabel: (-)-Jasmolin I, Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-, (1<em>S</em>)-2-methyl-4-oxo-3-(2<em>Z</em>)-2-penten-1-yl-2-cyclopenten-1-yl ester, (1<em>R</em>,3<em>R</em>)-, Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, (1<em>S</em>)-2-methyl-4-oxo-3-(2<em>Z</em>)-2-pentenyl-2-cyclopenten-1-yl ester, (1<em>R</em>,3<em>R</em>)-, Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, 2-methyl-4-oxo-3-(2-pentenyl)-2-cyclopenten-1-yl ester, [1<em>R</em>-[1α[<em>S</em>*(<em>Z</em>)],3β]]-, Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methylpropenyl)-, ester with 4-hydroxy-3-methyl-2-(2-pentenyl)-2-cyclopenten-1-one, Jasmoline I; object_uuid=fo-eb974a29caf6315e
cas_match_labels 1 — consensus_match group_key=jasmolini||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['chebi', 'pubchem']; cas_sources={'4466-14-2': ['chebi', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-eb974a29caf6315e: {'4466-14-2': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel [{'@value': '(1S)-2-methyl-4-oxo-3-[(2Z)-pent-2-en-1-yl]cyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(1S)-2-methyl-4-oxo-3-[(2Z)-pent-2-en-1-yl]cyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate', 'http://purl.obolibrary.org/obo/CHEBI_39113', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': '(1S)-2-methyl-4-oxo-3-[(2Z)-pent-2-en-1-yl]cyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(1S)-2-methyl-4-oxo-3-[(2Z)-pent-2-en-1-yl]cyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate', 'http://purl.obolibrary.org/obo/CHEBI_39113', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(-)-Jasmolin I', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4466-14-2', 'https://commonchemistry.cas.org/detail?cas_rn=4466-14-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-, (1<em>S</em>)-2-methyl-4-oxo-3-(2<em>Z</em>)-2-penten-1-yl-2-cyclopenten-1-yl ester, (1<em>R</em>,3<em>R</em>)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4466-14-2', 'https://commonchemistry.cas.org/detail?cas_rn=4466-14-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, (1<em>S</em>)-2-methyl-4-oxo-3-(2<em>Z</em>)-2-pentenyl-2-cyclopenten-1-yl ester, (1<em>R</em>,3<em>R</em>)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4466-14-2', 'https://commonchemistry.cas.org/detail?cas_rn=4466-14-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, 2-methyl-4-oxo-3-(2-pentenyl)-2-cyclopenten-1-yl ester, [1<em>R</em>-[1α[<em>S</em>*(<em>Z</em>)],3β]]-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4466-14-2', 'https://commonchemistry.cas.org/detail?cas_rn=4466-14-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methylpropenyl)-, ester with 4-hydroxy-3-methyl-2-(2-pentenyl)-2-cyclopenten-1-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4466-14-2', 'https://commonchemistry.cas.org/detail?cas_rn=4466-14-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Jasmoline I', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:4466-14-2', 'https://commonchemistry.cas.org/detail?cas_rn=4466-14-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=jasmolini||dimension=Environmental > media=Ground > geography=Unknown; cas=4466-14-2; added Common Chemistry CAS names as altLabel: (-)-Jasmolin I, Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-, (1<em>S</em>)-2-methyl-4-oxo-3-(2<em>Z</em>)-2-penten-1-yl-2-cyclopenten-1-yl ester, (1<em>R</em>,3<em>R</em>)-, Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, (1<em>S</em>)-2-methyl-4-oxo-3-(2<em>Z</em>)-2-pentenyl-2-cyclopenten-1-yl ester, (1<em>R</em>,3<em>R</em>)-, Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, 2-methyl-4-oxo-3-(2-pentenyl)-2-cyclopenten-1-yl ester, [1<em>R</em>-[1α[<em>S</em>*(<em>Z</em>)],3β]]-, Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methylpropenyl)-, ester with 4-hydroxy-3-methyl-2-(2-pentenyl)-2-cyclopenten-1-one, Jasmoline I; object_uuid=fo-eb974a29caf6315e
cas_match_labels None {'4466-14-2': 'exactMatch'} group_key=jasmolini||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['chebi', 'pubchem']; cas_sources={'4466-14-2': ['chebi', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-eb974a29caf6315e: {'4466-14-2': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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