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7alpha-hydroxy-5beta-cholestan-3-one

MNXM728194 is deprecated and replaced by MNXM728193

Properties

Image

Occurences in reactions

MNX_ID

MNXM728193

	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	4

formula

C₂₇H₄₆O₂

charge

mass

402.34978

reference

chebi:2290

InChIKey

HWOOALPDOJHOPO-YREUSXKVSA-N

InChI

InChI=1S/C27H46O2/c1-17(2)7-6-8-18(3)21-9-10-22-25-23(12-14-27(21,22)5)26(4)13-11-20(28)15-19(26)16-24(25)29/h17-19,21-25,29H,6-16H2,1-5H3/t18-,19+,21-,22+,23+,24-,25+,26+,27-/m1/s1

SMILES

CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@H]3[C@H](CC[C@@]21C)[C@@]1(C)CCC(=O)C[C@H]1C[C@H]3O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
reactome:R-ALL-191980 reactomeM:R-ALL-191980 CHEBI:2290 chebi:2290	7alpha-hydroxy-5beta-cholestan-3-one 5beta-Cholestan-7alpha-ol-3-one 5beta-cholestan-7alpha-ol-3-one 7alpha-Hydroxy-5beta-cholestan-3-one
bigg.metabolite:xol7ah biggM:xol7ah sabiork.compound:7923 sabiorkM:7923	7alpha-Hydroxy-5beta-cholestan-3-one
kegg.compound:C05451 keggC:C05451	7alpha-Hydroxy-5beta-cholestan-3-one 5beta-Cholestan-7alpha-ol-3-one
seed.compound:cpd03234 seedM:cpd03234	7alpha-Hydroxy-5beta-cholestan-3-one 5beta-Cholestan-7alpha-ol-3-one 7alpha-hydroxy-5beta-cholestan-3-one
lipidmaps:LMST04030112 lipidmapsM:LMST04030112	7alpha-Hydroxy-5beta-cholestan-3-one O2 ST 27:1
metacyc.compound:CPD-10548 metacycM:CPD-10548 SLM:000485677 slm:000485677	7alpha-hydroxy-5beta-cholestan-3-one
biggM:M_xol7ah keggC:M_C05451 seedM:M_cpd03234	secondary/obsolete/fantasy identifier