CHEBI:176149 - Lucidenic acid M

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Lucidenic acid M
ChEBI ID CHEBI:176149
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C27H42O6
Net Charge 0
Average Mass 462.627
Monoisotopic Mass 462.29814
InChI InChI=1S/C27H42O6/c1-14(7-8-21(32)33)15-11-20(31)27(6)23-16(28)12-18-24(2,3)19(30)9-10-25(18,4)22(23)17(29)13-26(15,27)5/h14-16,18-20,28,30-31H,7-13H2,1-6H3,(H,32,33)
InChIKey DPRVTGUHOBXEIW-UHFFFAOYSA-N
SMILES OC1C2(C(C(C1)C(CCC(O)=O)C)(CC(=O)C=3C4(C(C(C(O)CC4)(C)C)CC(O)C23)C)C)C
ChEBI Ontology
Outgoing Lucidenic acid M (CHEBI:176149) is a triterpenoid (CHEBI:36615)
IUPAC Name
4-(3,7,15-trihydroxy-4,4,10,13,14-pentamethyl-11-oxo-1,2,3,5,6,7,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl)pentanoic acid
Manual Xref Database
HMDB0035973 HMDB
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