(2R)-2-[3-(4,8-dimethyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)propanoylamino]-3-(5-oxidanyl-1H-indol-3-yl)propanoate

Systemtic Name: (2R)-2-[3-(4,8-dimethyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)propanoylamino]-3-(5-oxidanyl-1H-indol-3-yl)propanoate Openeye Name: (2R)-2-[3-(7-hydroxy-4,8-dimethyl-2-oxo-chromen-3-yl)propanoylamino]-3-(5-hydroxy-1H-indol-3-yl)propanoate CAS Name: (2R)-2-[[3-(7-hydroxy-4,8-dimethyl-2-oxo-1-benzopyran-3-yl)-1-oxopropyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoate IUPAC Name: (2R)-2-[3-(7-hydroxy-4,8-dimethyl-2-oxochromen-3-yl)propanoylamino]-3-(5-hydroxy-1H-indol-3-yl)propanoate Traditional Name: (2R)-3-(5-hydroxy-1H-indol-3-yl)-2-[3-(7-hydroxy-2-keto-4,8-dimethyl-chromen-3-yl)propanoylamino]propionate Formula: C25H23N2O7- MolecularWeight: 463.45932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)O)CCC(=O)NC(CC3=CNC4=C3C=C(C=C4)O)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)O)CCC(=O)N[C@H](CC3=CNC4=C3C=C(C=C4)O)C(=O)[O-]

InChI

InChI=1S/C25H24N2O7/c1-12-16-4-7-21(29)13(2)23(16)34-25(33)17(12)5-8-22(30)27-20(24(31)32)9-14-11-26-19-6-3-15(28)10-18(14)19/h3-4,6-7,10-11,20,26,28-29H,5,8-9H2,1-2H3,(H,27,30)(H,31,32)/p-1/t20-/m1/s1