O1-[(2S,3S)-2-[[(2S,3S)-2-azanyl-3-methyl-pentanoyl]amino]-3-methyl-pentanoyl] O5-phosphono (2S)-2-[[(2S)-5-azanyl-2-[[(2S)-2-azanyl-3-oxidanyl-propanoyl]amino]-5-oxidanylidene-pentanoyl]amino]pentanedioate

Systemtic Name: O1-[(2S,3S)-2-[[(2S,3S)-2-azanyl-3-methyl-pentanoyl]amino]-3-methyl-pentanoyl] O5-phosphono (2S)-2-[[(2S)-5-azanyl-2-[[(2S)-2-azanyl-3-oxidanyl-propanoyl]amino]-5-oxidanylidene-pentanoyl]amino]pentanedioate Openeye Name: O1-[(2S,3S)-2-[[(2S,3S)-2-amino-3-methyl-pentanoyl]amino]-3-methyl-pentanoyl] O5-phosphono (2S)-2-[[(2S)-5-amino-2-[[(2S)-2-amino-3-hydroxy-propanoyl]amino]-5-oxo-pentanoyl]amino]pentanedioate CAS Name: (2S)-2-[[(2S)-5-amino-2-[[(2S)-2-amino-3-hydroxy-1-oxopropyl]amino]-1,5-dioxopentyl]amino]pentanedioic acid O1-[(2S,3S)-2-[[(2S,3S)-2-amino-3-methyl-1-oxopentyl]amino]-3-methyl-1-oxopentyl] ester O5-phosphono ester IUPAC Name: 1-O-[(2S,3S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-3-methylpentanoyl] 5-O-phosphono (2S)-2-[[(2S)-5-amino-2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]-5-oxopentanoyl]amino]pentanedioate Traditional Name: (2S)-2-[[(2S)-5-amino-2-[[(2S)-2-amino-3-hydroxy-propanoyl]amino]-5-keto-pentanoyl]amino]glutaric acid O1-[(2S,3S)-2-[[(2S,3S)-2-amino-3-methyl-pentanoyl]amino]-3-methyl-pentanoyl] ester O5-phosphono ester Formula: C25H45N6O13P MolecularWeight: 668.630961

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(C(C)CC)C(=O)OC(=O)C(CCC(=O)OP(=O)(O)O)NC(=O)C(CCC(=O)N)NC(=O)C(CO)N)N

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H]([C@@H](C)CC)C(=O)OC(=O)[C@H](CCC(=O)OP(=O)(O)O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CO)N)N

InChI

InChI=1S/C25H45N6O13P/c1-5-12(3)19(28)23(37)31-20(13(4)6-2)25(39)43-24(38)16(8-10-18(34)44-45(40,41)42)30-22(36)15(7-9-17(27)33)29-21(35)14(26)11-32/h12-16,19-20,32H,5-11,26,28H2,1-4H3,(H2,27,33)(H,29,35)(H,30,36)(H,31,37)(H2,40,41,42)/t12-,13-,14-,15-,16-,19-,20-/m0/s1