16alpha-hydroxy-beta-amyrin (CHEBI:140655)

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CHEBI:140655 - 16α-hydroxy-β-amyrin

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ChEBI ID	CHEBI:140655
ChEBI Name	16α-hydroxy-β-amyrin
Stars
ASCII Name	16alpha-hydroxy-beta-amyrin
Submitter	Kristian Axelsen
Downloads	Molfile

Formula	C30H50O2
Net Charge	0
Average Mass	442.728
Monoisotopic Mass	442.38108
SMILES	[H][C@]12CC=C3[C@]4([H])CC(C)(C)CC[C@]4(C)[C@H](O)C[C@@]3(C)[C@]1(C)CC[C@@]1([H])C(C)(C)[C@@H](O)CC[C@]21C
InChI	InChI=1S/C30H50O2/c1-25(2)15-16-27(5)20(17-25)19-9-10-22-28(6)13-12-23(31)26(3,4)21(28)11-14-29(22,7)30(19,8)18-24(27)32/h9,20-24,31-32H,10-18H2,1-8H3/t20-,21-,22+,23-,24+,27-,28-,29+,30+/m0/s1
InChIKey	VLRYIIPJIVGFIV-PXCMFJNASA-N

ChEBI Ontology

Outgoing Relation(s)
	16α-hydroxy-β-amyrin (CHEBI:140655) has functional parent β-amyrin (CHEBI:10352)
	16α-hydroxy-β-amyrin (CHEBI:140655) has parent hydride oleanane (CHEBI:36481)
	16α-hydroxy-β-amyrin (CHEBI:140655) is a pentacyclic triterpenoid (CHEBI:25872)

UniProt Name	Source
16α-hydroxy-β-amyrin	UniProt

Manual Xrefs	Databases
CPD-20420	MetaCyc

Citations