Picrasin D (CHEBI:80891)

CHEBI:80891 - Picrasin D

Formula	C22H30O6
Net Charge	0
Average Mass	390.476
Monoisotopic Mass	390.20424
SMILES	[H][C@@]12[C@@H]3OCO[C@H]3C(C)[C@]3([H])CC(=O)O[C@]([H])(C[C@@]4([H])[C@H](C)C=C(OC)C(=O)[C@]14C)[C@]23C
InChI	InChI=1S/C22H30O6/c1-10-6-14(25-5)20(24)22(4)12(10)7-15-21(3)13(8-16(23)28-15)11(2)17-18(19(21)22)27-9-26-17/h6,10-13,15,17-19H,7-9H2,1-5H3/t10-,11?,12+,13+,15-,17+,18-,19+,21-,22+/m1/s1
InChIKey	GNPWDPZTRHBTJY-ZXXQBWPGSA-N

ChEBI Ontology

Outgoing Relation(s)
	Picrasin D (CHEBI:80891) is a triterpenoid (CHEBI:36615)

Manual Xrefs	Databases
C17051	KEGG COMPOUND

Registry Numbers	Sources
CAS:33204-37-4	KEGG COMPOUND