N-[4-azanyl-7-(3-azanylpropanoyl)-6-methanoyl-2,11-dimethyl-9-oxidanyl-5,8-bis(oxidanylidene)-7-phenyl-dodecan-6-yl]-N,4-dimethyl-2-oxidanyl-pent-4-enamide

Systemtic Name: N-[4-azanyl-7-(3-azanylpropanoyl)-6-methanoyl-2,11-dimethyl-9-oxidanyl-5,8-bis(oxidanylidene)-7-phenyl-dodecan-6-yl]-N,4-dimethyl-2-oxidanyl-pent-4-enamide Openeye Name: N-[1-(2-amino-4-methyl-pentanoyl)-2-(3-aminopropanoyl)-1-formyl-4-hydroxy-6-methyl-3-oxo-2-phenyl-heptyl]-2-hydroxy-N,4-dimethyl-pent-4-enamide CAS Name: N-[4-amino-7-(3-amino-1-oxopropyl)-6-formyl-9-hydroxy-2,11-dimethyl-5,8-dioxo-7-phenyldodecan-6-yl]-2-hydroxy-N,4-dimethyl-4-pentenamide IUPAC Name: N-[4-amino-7-(3-aminopropanoyl)-6-formyl-9-hydroxy-2,11-dimethyl-5,8-dioxo-7-phenyldodecan-6-yl]-2-hydroxy-N,4-dimethylpent-4-enamide Traditional Name: N-[1-(2-amino-4-methyl-pentanoyl)-2-(3-aminopropanoyl)-1-formyl-4-hydroxy-3-keto-6-methyl-2-phenyl-heptyl]-2-hydroxy-N,4-dimethyl-pent-4-enamide Formula: C31H47N3O7 MolecularWeight: 573.72078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)C(C=O)(C(C1=CC=CC=C1)(C(=O)CCN)C(=O)C(CC(C)C)O)N(C)C(=O)C(CC(=C)C)O)N

Isomeric SMILES

CC(C)CC(C(=O)C(C=O)(C(C1=CC=CC=C1)(C(=O)CCN)C(=O)C(CC(C)C)O)N(C)C(=O)C(CC(=C)C)O)N

InChI

InChI=1S/C31H47N3O7/c1-19(2)15-23(33)27(39)30(18-35,34(7)29(41)25(37)17-21(5)6)31(26(38)13-14-32,22-11-9-8-10-12-22)28(40)24(36)16-20(3)4/h8-12,18-20,23-25,36-37H,5,13-17,32-33H2,1-4,6-7H3