(2R)-2-[3-(4,8-dimethyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)propanoylamino]-4-methyl-pentanoic acid

Systemtic Name: (2R)-2-[3-(4,8-dimethyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)propanoylamino]-4-methyl-pentanoic acid Openeye Name: (2R)-2-[3-(7-hydroxy-4,8-dimethyl-2-oxo-chromen-3-yl)propanoylamino]-4-methyl-pentanoic acid CAS Name: (2R)-2-[[3-(7-hydroxy-4,8-dimethyl-2-oxo-1-benzopyran-3-yl)-1-oxopropyl]amino]-4-methylpentanoic acid IUPAC Name: (2R)-2-[3-(7-hydroxy-4,8-dimethyl-2-oxochromen-3-yl)propanoylamino]-4-methylpentanoic acid Traditional Name: (2R)-2-[3-(7-hydroxy-2-keto-4,8-dimethyl-chromen-3-yl)propanoylamino]-4-methyl-valeric acid Formula: C20H25NO6 MolecularWeight: 375.4156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)O)CCC(=O)NC(CC(C)C)C(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)O)CCC(=O)N[C@H](CC(C)C)C(=O)O

InChI

InChI=1S/C20H25NO6/c1-10(2)9-15(19(24)25)21-17(23)8-6-14-11(3)13-5-7-16(22)12(4)18(13)27-20(14)26/h5,7,10,15,22H,6,8-9H2,1-4H3,(H,21,23)(H,24,25)/t15-/m1/s1