CHEBI:175741 - Lucidenic acid I

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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 I
ChEBI ID CHEBI:175741
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C27H38O7
Net Charge 0
Average Mass 474.594
Monoisotopic Mass 474.26175
InChI InChI=1S/C27H38O7/c1-14(6-7-21(33)34)15-10-20(32)27(5)23-16(29)11-18-24(2,9-8-19(31)25(18,3)13-28)22(23)17(30)12-26(15,27)4/h14-15,18-19,28,31H,6-13H2,1-5H3,(H,33,34)
InChIKey VJIIJXSVQOCMDZ-UHFFFAOYSA-N
SMILES OC1C(C2C(C3=C(C4(C(C(CC4=O)C(CCC(O)=O)C)(CC3=O)C)C)C(=O)C2)(CC1)C)(CO)C
ChEBI Ontology
Outgoing Lucidenic acid I (CHEBI:175741) is a triterpenoid (CHEBI:36615)
IUPAC Name
4-[3-hydroxy-4-(hydroxymethyl)-4,10,13,14-tetramethyl-7,11,15-trioxo-1,2,3,5,6,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
Manual Xref Database
HMDB0035976 HMDB
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