4α-carboxy-ergosta-7,24(241)-dien-3β-ol
Chemical Formula:
C29H45O3
Molecular Weight:
441.673 Daltons
Monoisotopic Mass:
442.34469534289997 Daltons
SMILES:
CC(C)C(=C)CCC(C)[CH]3(CC[CH]4(C2(=CC[CH]1(C(C([O-])=O)C(O)CCC(C)1[CH]2CCC(C)34))))
InChI:
1S/C29H46O3/c1-17(2)18(3)7-8-19(4)21-11-12-22-20-9-10-24-26(27(31)32)25(30)14-16-29(24,6)23(20)13-15-28(21,22)5/h9,17,19,21-26,30H,3,7-8,10-16H2,1-2,4-6H3,(H,31,32)/p-1/t19-,21-,22+,23+,24+,25+,26+,28-,29-/m1/s1
InChIKey:
Databases
MetaCyc:
CPD-12909
PubChem (CID):
102515460
Seed:
cpd23631
MetaNetX:
MNXM10249
ChEBI:
142850