(4R)-4-[[(2S)-2-[[(2S)-2-azanyl-3-(4-phosphonooxyphenyl)propanoyl]amino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]-6-[[(2S)-3-methyl-1-oxidanyl-1-oxidanylidene-butan-2-yl]amino]-6-oxidanylidene-hexanoic acid

Systemtic Name: (4R)-4-[[(2S)-2-[[(2S)-2-azanyl-3-(4-phosphonooxyphenyl)propanoyl]amino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]-6-[[(2S)-3-methyl-1-oxidanyl-1-oxidanylidene-butan-2-yl]amino]-6-oxidanylidene-hexanoic acid Openeye Name: (4R)-4-[[(2S)-2-[[(2S)-2-amino-3-(4-phosphonooxyphenyl)propanoyl]amino]-4-hydroxy-4-oxo-butanoyl]amino]-6-[[(1S)-1-carboxy-2-methyl-propyl]amino]-6-oxo-hexanoic acid CAS Name: (4R)-4-[[(2S)-2-[[(2S)-2-amino-1-oxo-3-(4-phosphonooxyphenyl)propyl]amino]-4-hydroxy-1,4-dioxobutyl]amino]-6-[[(2S)-1-hydroxy-3-methyl-1-oxobutan-2-yl]amino]-6-oxohexanoic acid IUPAC Name: (4R)-4-[[(2S)-2-[[(2S)-2-amino-3-(4-phosphonooxyphenyl)propanoyl]amino]-4-hydroxy-4-oxobutanoyl]amino]-6-[[(2S)-1-hydroxy-3-methyl-1-oxobutan-2-yl]amino]-6-oxohexanoic acid Traditional Name: (4R)-4-[[(2S)-2-[[(2S)-2-amino-3-(4-phosphonooxyphenyl)propanoyl]amino]-4-hydroxy-4-keto-butanoyl]amino]-6-[[(1S)-1-carboxy-2-methyl-propyl]amino]-6-keto-hexanoic acid Formula: C24H35N4O13P MolecularWeight: 618.527461

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)CC(CCC(=O)O)NC(=O)C(CC(=O)O)NC(=O)C(CC1=CC=C(C=C1)OP(=O)(O)O)N

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NC(=O)C[C@@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC1=CC=C(C=C1)OP(=O)(O)O)N

InChI

InChI=1S/C24H35N4O13P/c1-12(2)21(24(36)37)28-18(29)10-14(5-8-19(30)31)26-23(35)17(11-20(32)33)27-22(34)16(25)9-13-3-6-15(7-4-13)41-42(38,39)40/h3-4,6-7,12,14,16-17,21H,5,8-11,25H2,1-2H3,(H,26,35)(H,27,34)(H,28,29)(H,30,31)(H,32,33)(H,36,37)(H2,38,39,40)/t14-,16+,17+,21+/m1/s1