CHEBI:176229 - Ganoderic acid H

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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 Ganoderic acid H
ChEBI ID CHEBI:176229
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C32H44O9
Net Charge 0
Average Mass 572.695
Monoisotopic Mass 572.29853
InChI InChI=1S/C32H44O9/c1-15(11-18(34)12-16(2)28(39)40)19-13-23(37)32(8)24-20(35)14-21-29(4,5)22(36)9-10-30(21,6)25(24)26(38)27(31(19,32)7)41-17(3)33/h15-16,19,21-22,27,36H,9-14H2,1-8H3,(H,39,40)
InChIKey YCXUCEXEMJPDRZ-UHFFFAOYSA-N
SMILES O(C1C2(C(C3=C(C4(C(C(C(O)CC4)(C)C)CC3=O)C)C1=O)(C(=O)CC2C(CC(=O)CC(C)C(O)=O)C)C)C)C(=O)C
Metabolite of Species Details
Ganoderma lucidum (NCBI:txid5315) See: DOI
ChEBI Ontology
Outgoing Ganoderic acid H (CHEBI:176229) is a triterpenoid (CHEBI:36615)
IUPAC Names
6-(12-acetyloxy-3-hydroxy-4,4,10,13,14-pentamethyl-7,11,15-trioxo-1,2,3,5,6,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl)-2-methyl-4-oxoheptanoic acid
6-[(3S,12S,14R)-12-acetyloxy-3-hydroxy-4,4,10,13,14-pentamethyl-7,11,15-trioxo-1,2,3,5,6,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid
Manual Xrefs Databases
28566040 ChemSpider
HMDB0035987 HMDB
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