Antcamphorol A (CHEBI:225721)

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CHEBI:225721 - Antcamphorol A

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ChEBI ID	CHEBI:225721
ChEBI Name	Antcamphorol A
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C31H50O3
Net Charge	0
Average Mass	470.738
Monoisotopic Mass	470.37600
SMILES	CC1=C2C3=C(CC[C@]2(C)[C@@H]([C@H]2CC[C@](CO)(C(C)C)OC2)C1)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3
InChI	InChI=1S/C31H50O3/c1-19(2)31(18-32)15-10-21(17-34-31)24-16-20(3)27-22-8-9-25-28(4,5)26(33)12-14-29(25,6)23(22)11-13-30(24,27)7/h19,21,24-26,32-33H,8-18H2,1-7H3/t21-,24+,25-,26-,29+,30+,31-/m0/s1
InChIKey	HRRQDONQMPIPDM-UZPKRPIASA-N

Species of Metabolite	Component	Source	Comments
Taiwanofungus camphoratus (ncbitaxon:2696576)	-	PubMed (31891260)

ChEBI Ontology

Outgoing Relation(s)
	Antcamphorol A (CHEBI:225721) is a 3β-hydroxy steroid (CHEBI:36836)

IUPAC Name
(3S,5R,10S,13R,17R)-17-[(3R,6R)-6-(hydroxymethyl)-6-propan-2-yloxan-3-yl]-4,4,10,13,15-pentamethyl-1,2,3,5,6,7,11,12,16,17-decahydrocyclopenta[a]phenanthren-3-ol