11-oxo-lucidadiol (CHEBI:200148)

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CHEBI:200148 - 11-oxo-lucidadiol

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ChEBI ID	CHEBI:200148
ChEBI Name	11-oxo-lucidadiol
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C30H46O4
Net Charge	0
Average Mass	470.694
Monoisotopic Mass	470.33961
SMILES	CC(=CCC[C@@H](C)[C@H]1CC[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3=O)CO
InChI	InChI=1S/C30H46O4/c1-18(17-31)9-8-10-19(2)20-11-14-29(6)26-21(32)15-23-27(3,4)24(34)12-13-28(23,5)25(26)22(33)16-30(20,29)7/h9,19-20,23-24,31,34H,8,10-17H2,1-7H3/t19-,20-,23+,24+,28+,29+,30-/m1/s1
InChIKey	GUKOXUOJFUSHJH-OCBIZMEBSA-N

Species of Metabolite	Component	Source	Comments
Haddowia longipes (ncbitaxon:1579230)	-	PubMed (25577284)

ChEBI Ontology

Outgoing Relation(s)
	11-oxo-lucidadiol (CHEBI:200148) is a triterpenoid (CHEBI:36615)

IUPAC Name
(3S,5R,10S,13R,14R,17R)-3-hydroxy-17-[(2R)-7-hydroxy-6-methylhept-5-en-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthrene-7,11-dione

Manual Xrefs	Databases
78442278	ChemSpider