CHEBI:203461 - Ganodermatetraol

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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 Ganodermatetraol
ChEBI ID CHEBI:203461
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C30H48O4
Net Charge 0
Average Mass 472.710
Monoisotopic Mass 472.35526
InChI InChI=1S/C30H48O4/c1-19(8-7-9-20(17-31)18-32)23-16-26(34)30(6)22-10-11-24-27(2,3)25(33)13-14-28(24,4)21(22)12-15-29(23,30)5/h9-10,12,19,23-26,31-34H,7-8,11,13-18H2,1-6H3/t19-,23-,24?,25+,26+,28-,29-,30-/m1/s1
InChIKey QLZRVDOOUFSGBH-DKUONJQNSA-N
SMILES O[C@@H]1C(C2[C@](C=3C([C@]4([C@]([C@@H]([C@@H](CCC=C(CO)CO)C)C[C@@H]4O)(C)CC3)C)=CC2)(C)CC1)(C)C
Metabolite of Species Details
Ganoderma sinense (NCBI:txid36075) See: PubMed
ChEBI Ontology
Outgoing Ganodermatetraol (CHEBI:203461) is a triterpenoid (CHEBI:36615)
IUPAC Name
(3S,10S,13R,14R,15S,17R)-17-[(2R)-7-hydroxy-6-(hydroxymethyl)hept-5-en-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthrene-3,15-diol
Manual Xref Database
78440947 ChemSpider
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