4α-carboxy-4β-methyl-5α-cholesta-8,24-dien-3β-ol

Chemical Formula:

C₂₉H₄₅O₃

Molecular Weight:

441.673 Daltons

Monoisotopic Mass:

442.34469534289997 Daltons

SMILES:

CC(C)=CCCC(C)[CH]3(CC[CH]4(C2(CC[CH]1(C(C([O-])=O)(C)C(O)CCC(C)1C=2CCC(C)34))))

InChI:

1S/C29H46O3/c1-18(2)8-7-9-19(3)21-11-12-22-20-10-13-24-28(5,23(20)14-16-27(21,22)4)17-15-25(30)29(24,6)26(31)32/h8,19,21-22,24-25,30H,7,9-17H2,1-6H3,(H,31,32)/p-1/t19-,21-,22+,24-,25+,27-,28-,29+/m1/s1

InChIKey:

MYWAIWDQTCHPTH-LJAIZBFVSA-M

Synonyms

4β-methyl-4α-carboxy-cholesta-8,24-dien-3β-ol
4β-methylzymosterol-4α-carboxylate

Databases

MetaCyc: CPD-4577

PubChem (CID): 57339293

HMDB: HMDB06927

ChEBI: 64925

KEGG: C15808

MetaNetX: MNXM37762