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B-norcholesterol

Properties

Image

Occurences in reactions

MNX_ID

MNXM43227

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

formula

C₂₆H₄₄O

charge

mass

372.33922

reference

chebi:79879

InChIKey

WEZNLBQEKWESKA-XSLNCIIRSA-N

InChI

InChI=1S/C26H44O/c1-17(2)7-6-8-18(3)22-9-10-23-21-16-19-15-20(27)11-13-25(19,4)24(21)12-14-26(22,23)5/h16-18,20-24,27H,6-15H2,1-5H3/t18-,20+,21+,22-,23+,24+,25+,26-/m1/s1

SMILES

CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:79879 chebi:79879	B-norcholesterol (3R,3aR,5aS,5bR,8S,10aS,10bS)-3a,5b-dimethyl-3-[(2R)-6-methylheptan-2-yl]-1,2,3,3a,4,5,5a,5b,6,7,8,9,10a,10b-tetradecahydrocyclopenta[a]fluoren-8-ol (3beta)-B-norcholest-5-en-3-ol 3beta-hydroxy-B-norcholest-5-ene 7-norcholest-5-en-3beta-ol B-norcholest-5-en-3beta-ol
seed.compound:cpd11069 seedM:cpd11069 kegg.compound:C15378 keggC:C15378	B-Norcholesterol 3beta-Hydroxy-B-norcholest-5-ene
keggC:M_C15378 seedM:M_cpd11069	secondary/obsolete/fantasy identifier