CHEBI:223333 - (24S)-3beta,24-dihydroxylanosta-7,9(11),25-triene

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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 (24S)-3beta,24-dihydroxylanosta-7,9(11),25-triene
ChEBI ID CHEBI:223333
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C30H48O2
Net Charge 0
Average Mass 440.712
Monoisotopic Mass 440.36543
InChI InChI=1S/C30H48O2/c1-19(2)24(31)11-9-20(3)21-13-17-30(8)23-10-12-25-27(4,5)26(32)15-16-28(25,6)22(23)14-18-29(21,30)7/h10,14,20-21,24-26,31-32H,1,9,11-13,15-18H2,2-8H3/t20-,21-,24+,25+,26+,28-,29-,30+/m1/s1
InChIKey KRWQHGRXPQWINO-QDSUYSSQSA-N
SMILES O[C@@H]1C([C@H]2[C@](C=3C([C@]4([C@]([C@@H]([C@@H](CC[C@H](O)C(=C)C)C)CC4)(C)CC3)C)=CC2)(C)CC1)(C)C
Metabolite of Species Details
Ganoderma (NCBI:txid5314) See: PubMed
ChEBI Ontology
Outgoing (24S)-3beta,24-dihydroxylanosta-7,9(11),25-triene (CHEBI:223333) is a triterpenoid (CHEBI:36615)
IUPAC Name
(3S,5R,10S,13R,14R,17R)-17-[(2R,5S)-5-hydroxy-6-methylhept-6-en-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-3-ol