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(24S)-5beta-cholestane-3alpha,7alpha,12alpha,24,26-pentol

Properties

Image

Occurences in reactions

MNX_ID

MNXM30750

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

formula

C₂₇H₄₈O₅

charge

mass

452.35017

reference

chebi:63835

InChIKey

CPKBPCHJXMSTOE-CJKJGBPISA-N

InChI

InChI=1S/C27H48O5/c1-15(5-8-22(30)16(2)14-28)19-6-7-20-25-21(13-24(32)27(19,20)4)26(3)10-9-18(29)11-17(26)12-23(25)31/h15-25,28-32H,5-14H2,1-4H3/t15-,16?,17+,18-,19-,20+,21+,22+,23-,24+,25+,26+,27-/m1/s1

SMILES

CC(CO)[C@@H](O)CC[C@@H](C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](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-193782 reactomeM:R-ALL-193782 CHEBI:63835 chebi:63835	(24S)-5beta-cholestane-3alpha,7alpha,12alpha,24,26-pentol 5beta-cholestan-3alpha,7alpha,12alpha,24(S),27-pentol
lipidmaps:LMST04030018 lipidmapsM:LMST04030018	5beta-Cholestane-3alpha,7alpha,12alpha,24,26-pentol O5 ST 27:0
hmdb:HMDB0062416	5beta-cholestan-3alpha,7alpha,12alpha,24(S),27-pentol (1S,2S,5R,7S,9R,10R,11S,14R,15R,16S)-14-[(2R,5S)-5,7-dihydroxy-6-methylheptan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecane-5,9,16-triol (24S)-5b-Cholestane-3a,7a,12a,24,26-pentol (24S)-5beta-cholestane-3alpha,7alpha,12alpha,24,26-pentol 5b-Cholestan-3a,7a,12a,24(S),27-pentol 5beta-Cholestan-3alpha,7alpha,12alpha,24(S),27-pentol
CHEBI:48732 chebi:48732	5beta-cholestane-3alpha,7alpha,12alpha,24,26-pentol 5beta-cholestan-3alpha,7alpha,12alpha,24,27-pentol
hmdb:HMDB62416	secondary/obsolete/fantasy identifier