(2S)-3-methyl-2-[2-[2-(2,3,5-trimethyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl)ethanoylamino]ethanoylamino]butanoate

Systemtic Name: (2S)-3-methyl-2-[2-[2-(2,3,5-trimethyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl)ethanoylamino]ethanoylamino]butanoate Openeye Name: (2S)-3-methyl-2-[[2-[[2-(2,3,5-trimethyl-7-oxo-furo[3,2-g]chromen-6-yl)acetyl]amino]acetyl]amino]butanoate CAS Name: (2S)-3-methyl-2-[[1-oxo-2-[[1-oxo-2-(2,3,5-trimethyl-7-oxo-6-furo[3,2-g][1]benzopyranyl)ethyl]amino]ethyl]amino]butanoate IUPAC Name: (2S)-3-methyl-2-[[2-[[2-(2,3,5-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]acetyl]amino]butanoate Traditional Name: (2S)-2-[[2-[[2-(7-keto-2,3,5-trimethyl-furo[3,2-g]chromen-6-yl)acetyl]amino]acetyl]amino]-3-methyl-butyrate Formula: C23H25N2O7- MolecularWeight: 441.4538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C3C(=C(C(=O)OC3=C2)CC(=O)NCC(=O)NC(C(C)C)C(=O)[O-])C)C

Isomeric SMILES

CC1=C(OC2=C1C=C3C(=C(C(=O)OC3=C2)CC(=O)NCC(=O)N[C@@H](C(C)C)C(=O)[O-])C)C

InChI

InChI=1S/C23H26N2O7/c1-10(2)21(22(28)29)25-20(27)9-24-19(26)7-16-12(4)15-6-14-11(3)13(5)31-17(14)8-18(15)32-23(16)30/h6,8,10,21H,7,9H2,1-5H3,(H,24,26)(H,25,27)(H,28,29)/p-1/t21-/m0/s1