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CHEBI:216068 - (+)-(5alpha,23R,24Z)-lanosta-8,24-dien-3,7-dioxo-23,26-gamma-lactone

Default Structure
ChEBI IDCHEBI:216068
ChEBI Name(+)-(5alpha,23R,24Z)-lanosta-8,24-dien-3,7-dioxo-23,26-gamma-lactone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H42O4
Net Charge0
Average Mass466.662
Monoisotopic Mass466.30831
SMILESCC1=C[C@@H](C[C@@H](C)[C@H]2CC[C@@]3(C)C4=C(CC[C@]23C)[C@@]2(C)CCC(=O)C(C)(C)[C@@H]2CC4=O)OC1=O
InChIInChI=1S/C30H42O4/c1-17(14-19-15-18(2)26(33)34-19)20-8-13-30(7)25-21(9-12-29(20,30)6)28(5)11-10-24(32)27(3,4)23(28)16-22(25)31/h15,17,19-20,23H,8-14,16H2,1-7H3/t17-,19-,20-,23+,28-,29-,30+/m1/s1
InChIKeyPUNXNTSNSVCCKV-QTBNWNMBSA-N
Species of MetaboliteComponentSourceComments
Ganoderma luteomarginatum (ncbitaxon:1579231) - PubMed (30240975)
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
(+)-(5alpha,23R,24Z)-lanosta-8,24-dien-3,7-dioxo-23,26-gamma-lactone (CHEBI:216068) is a withanolide (CHEBI:74716)
IUPAC Name 
(5R,10S,13R,14R,17R)-4,4,10,13,14-pentamethyl-17-[(2R)-1-[(2R)-4-methyl-5-oxo-2H-uran-2-yl]propan-2-yl]-2,5,6,11,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthrene-3,7-dione
Manual XrefsDatabases
78442212ChemSpider