ursulcholic acid (CHEBI:752515)

CHEBI:752515 - ursulcholic acid

Formula	C24H40O10S2
Net Charge	0
Average Mass	552.708
Monoisotopic Mass	552.20629
SMILES	[H][C@@]12C[C@H](OS(=O)(=O)O)CC[C@]1(C)[C@@]1([H])CC[C@@]3(C)[C@@]([H])(CC[C@]3([H])[C@H](C)CCC(=O)O)[C@]1([H])[C@@H](OS(=O)(=O)O)C2
InChI	InChI=1S/C24H40O10S2/c1-14(4-7-21(25)26)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(33-35(27,28)29)12-15(23)13-20(22)34-36(30,31)32/h14-20,22H,4-13H2,1-3H3,(H,25,26)(H,27,28,29)(H,30,31,32)/t14-,15+,16-,17-,18+,19+,20+,22+,23+,24-/m1/s1
InChIKey	BWXSDJHAJWTEAD-UZVSRGJWSA-N

ChEBI Ontology

Outgoing Relation(s)
	ursulcholic acid (CHEBI:752515) is a steroid sulfate (CHEBI:16158)