pretenellin A
Chemical Formula:
C21H24NO4
Molecular Weight:
354.425 Daltons
Monoisotopic Mass:
355.1783582961 Daltons
SMILES:
CCC(C=C(C=CC(=O)C2(C(=O)NC(CC1(C=CC(O)=CC=1))C([O-])=2))C)C
InChI:
1S/C21H25NO4/c1-4-13(2)11-14(3)5-10-18(24)19-20(25)17(22-21(19)26)12-15-6-8-16(23)9-7-15/h5-11,13,17,23,25H,4,12H2,1-3H3,(H,22,26)/p-1/b10-5+,14-11+
InChIKey:
Databases
MetaCyc:
CPD-17124
PubChem (CID):
91820312
MetaNetX:
MNXM148470