3-[4-[(4E,6E,8S,11Z)-15-methoxy-4,8,12-trimethyl-14-oxidanyl-15-oxidanylidene-pentadeca-4,6,11-trienyl]-5-oxidanylidene-2H-pyrrol-1-yl]propanoic acid

Systemtic Name: 3-[4-[(4E,6E,8S,11Z)-15-methoxy-4,8,12-trimethyl-14-oxidanyl-15-oxidanylidene-pentadeca-4,6,11-trienyl]-5-oxidanylidene-2H-pyrrol-1-yl]propanoic acid Openeye Name: 3-[4-[(4E,6E,8S,11Z)-14-hydroxy-15-methoxy-4,8,12-trimethyl-15-oxo-pentadeca-4,6,11-trienyl]-5-oxo-2H-pyrrol-1-yl]propanoic acid CAS Name: 3-[4-[(4E,6E,8S,11Z)-14-hydroxy-15-methoxy-4,8,12-trimethyl-15-oxopentadeca-4,6,11-trienyl]-5-oxo-2H-pyrrol-1-yl]propanoic acid IUPAC Name: 3-[4-[(4E,6E,8S,11Z)-14-hydroxy-15-methoxy-4,8,12-trimethyl-15-oxopentadeca-4,6,11-trienyl]-5-oxo-2H-pyrrol-1-yl]propanoic acid Traditional Name: 3-[3-[(4E,6E,8S,11Z)-14-hydroxy-15-keto-15-methoxy-4,8,12-trimethyl-pentadeca-4,6,11-trienyl]-2-keto-3-pyrrolin-1-yl]propionic acid Formula: C26H39NO6 MolecularWeight: 461.59096

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC=C(C)CC(C(=O)OC)O)C=CC=C(C)CCCC1=CCN(C1=O)CCC(=O)O

Isomeric SMILES

C[C@@H](CC/C=C(/C)\CC(C(=O)OC)O)/C=C/C=C(\C)/CCCC1=CCN(C1=O)CCC(=O)O

InChI

InChI=1S/C26H39NO6/c1-19(10-6-12-21(3)18-23(28)26(32)33-4)8-5-9-20(2)11-7-13-22-14-16-27(25(22)31)17-15-24(29)30/h5,8-9,12,14,19,23,28H,6-7,10-11,13,15-18H2,1-4H3,(H,29,30)/b8-5+,20-9+,21-12-/t19-,23?/m1/s1