3-[(2R)-3,5-dioxo-4-[(2E.4S,6S,8E,10E,12E)-4,6,12-trimethyltetradeca-2,8,10,12-tetraenoyl]pyrrolidin-2-yl]-2-hydroxy-2-methylpropanoate

Chemical Formula:

C₂₅H₃₄NO₆

Molecular Weight:

444.547 Daltons

Monoisotopic Mass:

445.24643786129997 Daltons

SMILES:

CC=C(C)C=CC=CCC(C)CC(C)C=CC(C1(C(=O)NC(CC(C)(O)C([O-])=O)C1=O))=O

InChI:

1S/C25H35NO6/c1-6-16(2)10-8-7-9-11-17(3)14-18(4)12-13-20(27)21-22(28)19(26-23(21)29)15-25(5,32)24(30)31/h6-10,12-13,17-19,21,32H,11,14-15H2,1-5H3,(H,26,29)(H,30,31)/p-1/b9-7+,10-8+,13-12+,16-6+/t17-,18+,19+,21?,25?/m0/s1

InChIKey:

KTJYXADTYUMBEL-GAGXJYKLSA-M

Synonyms

3-[(2R)-3,5-dioxo-4-[(2E.4S,6S,8E,10E,12E)-4,6,12-trimethyltetradeca-2,8,10,12-tetraenoyl]pyrrolidin-2-yl]-2-hydroxy-2-methylpropanoic acid

Databases

MetaCyc: CPD-18283

PubChem (CID): 102515452

MetaNetX: MNXM163666