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(24S)-3alpha,7alpha,24-trihydroxy-5beta-cholestan-26-al

Properties

Image

Occurences in reactions

MNX_ID

MNXM30749

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

formula

C₂₇H₄₆O₄

charge

mass

434.33961

reference

chebi:63848

InChIKey

GDUNLMLXJUYQIN-MNABXBHASA-N

InChI

InChI=1S/C27H46O4/c1-16(5-8-23(30)17(2)15-28)20-6-7-21-25-22(10-12-27(20,21)4)26(3)11-9-19(29)13-18(26)14-24(25)31/h15-25,29-31H,5-14H2,1-4H3/t16-,17?,18+,19-,20-,21+,22+,23+,24-,25+,26+,27-/m1/s1

SMILES

CC(C=O)[C@@H](O)CC[C@@H](C)[C@H]1CC[C@H]2[C@H]3[C@H](CC[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-193716 reactomeM:R-ALL-193716 CHEBI:63848 chebi:63848	(24S)-3alpha,7alpha,24-trihydroxy-5beta-cholestan-26-al 3alpha,7alpha,24(S)-trihydroxy-5beta-cholestan-27-al
hmdb:HMDB0062208	3alpha,7alpha,24(S)-trihydroxy-5beta-cholestan-27-al (24S)-3a,7a,24-Trihydroxy-5b-cholestan-26-al (24S)-3alpha,7alpha,24-trihydroxy-5beta-cholestan-26-al (3S,6R)-6-[(1S,2S,5R,7S,9R,10R,11S,14R,15R)-5,9-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-14-yl]-3-hydroxy-2-methylheptanal 3a,7a,24(S)-Trihydroxy-5b-cholestan-27-al 3alpha,7alpha,24(S)-Trihydroxy-5beta-cholestan-27-al
lipidmaps:LMST04030154 lipidmapsM:LMST04030154	3alpha,7alpha,24-trihydroxy-5beta-cholestan-26-al 3alpha,7alpha,24-trihydroxy-5beta-cholestan-26-al 3alpha,7alpha,24-trihydroxy-5beta-cholestan-27-al O4 ST 27:1
CHEBI:48734 chebi:48734	3alpha,7alpha,24-trihydroxy-5beta-cholestan-26-al 3alpha,7alpha,24-trihydroxy-5beta-cholestan-27-al
hmdb:HMDB62208	secondary/obsolete/fantasy identifier