methyl 2-[[7-[2-[(E)-5-methyl-3-oxidanyl-non-1-enyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]-6-oxidanylidene-heptanoyl]amino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[[7-[2-[(E)-5-methyl-3-oxidanyl-non-1-enyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]-6-oxidanylidene-heptanoyl]amino]-3-phenyl-propanoate Openeye Name: methyl 2-[[7-[3-hydroxy-2-[(E)-3-hydroxy-5-methyl-non-1-enyl]-5-oxo-cyclopentyl]-6-oxo-heptanoyl]amino]-3-phenyl-propanoate CAS Name: 2-[[7-[3-hydroxy-2-[(E)-3-hydroxy-5-methylnon-1-enyl]-5-oxocyclopentyl]-1,6-dioxoheptyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[[7-[3-hydroxy-2-[(E)-3-hydroxy-5-methylnon-1-enyl]-5-oxocyclopentyl]-6-oxoheptanoyl]amino]-3-phenylpropanoate Traditional Name: 2-[[7-[3-hydroxy-2-[(E)-3-hydroxy-5-methyl-non-1-enyl]-5-keto-cyclopentyl]-6-keto-heptanoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C32H47NO7 MolecularWeight: 557.71808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)CC(C=CC1C(CC(=O)C1CC(=O)CCCCC(=O)NC(CC2=CC=CC=C2)C(=O)OC)O)O

Isomeric SMILES

CCCCC(C)CC(/C=C/C1C(CC(=O)C1CC(=O)CCCCC(=O)NC(CC2=CC=CC=C2)C(=O)OC)O)O

InChI

InChI=1S/C32H47NO7/c1-4-5-11-22(2)18-25(35)16-17-26-27(30(37)21-29(26)36)20-24(34)14-9-10-15-31(38)33-28(32(39)40-3)19-23-12-7-6-8-13-23/h6-8,12-13,16-17,22,25-29,35-36H,4-5,9-11,14-15,18-21H2,1-3H3,(H,33,38)/b17-16+