CHEBI:181590 - (1S,4aS,5R,6R)-6-hydroxy-5-[(Z)-5-hydroxy-3-methylpent-3-enyl]-1,4a,6-trimethyl-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid

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ChEBI Name (1S,4aS,5R,6R)-6-hydroxy-5-[(Z)-5-hydroxy-3-methylpent-3-enyl]-1,4a,6-trimethyl-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
ChEBI ID CHEBI:181590
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H34O4
Net Charge 0
Average Mass 338.488
Monoisotopic Mass 338.24571
InChI InChI=1S/C20H34O4/c1-14(9-13-21)6-7-16-18(2)10-5-11-19(3,17(22)23)15(18)8-12-20(16,4)24/h9,15-16,21,24H,5-8,10-13H2,1-4H3,(H,22,23)/b14-9-/t15?,16-,18+,19+,20-/m1/s1
InChIKey GFYNKSLVMQVEBT-BAUVLOOGSA-N
SMILES O[C@]1([C@@H]([C@@]2(C([C@@](CCC2)(C)C(O)=O)CC1)C)CC/C(/C)=C\CO)C
ChEBI Ontology
Outgoing (1S,4aS,5R,6R)-6-hydroxy-5-[(Z)-5-hydroxy-3-methylpent-3-enyl]-1,4a,6-trimethyl-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (CHEBI:181590) is a diterpenoid (CHEBI:23849)
IUPAC Name
(1S,4aS,5R,6R)-6-hydroxy-5-[(Z)-5-hydroxy-3-methylpent-3-enyl]-1,4a,6-trimethyl-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
Manual Xref Database
22913574 ChemSpider
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