(25R)-5β-cholestane-3α,7α,26-triol
Chemical Formula:
C27H48O3
Molecular Weight:
420.674 Daltons
Monoisotopic Mass:
420.3603454071 Daltons
SMILES:
CC(CO)CCCC(C)[CH]1(CC[CH]2(C(C)1CC[CH]3([CH]2C(O)C[CH]4(C(C)3CCC(O)C4))))
InChI:
1S/C27H48O3/c1-17(16-28)6-5-7-18(2)21-8-9-22-25-23(11-13-27(21,22)4)26(3)12-10-20(29)14-19(26)15-24(25)30/h17-25,28-30H,5-16H2,1-4H3/t17-,18-,19+,20-,21-,22+,23+,24-,25+,26+,27-/m1/s1
InChIKey:
Databases
MetaCyc:
CPD-10586
MetaboLights:
MTBLC28540
HMDB:
HMDB12455
LIPID MAPS:
LMST04030020
PubChem (CID):
46926093
ChEBI:
28540
KEGG:
c05444
Seed:
cpd22725
MetaNetX:
MNXM163946