(4S)-4-azanyl-5-[[(2S,3R)-1-[[(2S,3S)-1-[[(2S)-6-azanyl-1-[[(2S,3R)-1-[[(2S)-4-azanyl-1-[[(2S,3R)-1,3-bis(oxidanyl)-1-oxidanylidene-butan-2-yl]amino]-1,4-bis(oxidanylidene)butan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: (4S)-4-azanyl-5-[[(2S,3R)-1-[[(2S,3S)-1-[[(2S)-6-azanyl-1-[[(2S,3R)-1-[[(2S)-4-azanyl-1-[[(2S,3R)-1,3-bis(oxidanyl)-1-oxidanylidene-butan-2-yl]amino]-1,4-bis(oxidanylidene)butan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: (4S)-4-amino-5-[[(1S,2R)-1-[[(1S,2S)-1-[[(1S)-5-amino-1-[[(1S,2R)-1-[[(1S)-3-amino-1-[[(1S,2R)-1-carboxy-2-hydroxy-propyl]carbamoyl]-3-oxo-propyl]carbamoyl]-2-hydroxy-propyl]carbamoyl]pentyl]carbamoyl]-2-methyl-butyl]carbamoyl]-2-hydroxy-propyl]amino]-5-oxo-pentanoic acid CAS Name: (4S)-4-amino-5-[[(2S,3R)-1-[[(2S,3S)-1-[[(2S)-6-amino-1-[[(2S,3R)-1-[[(2S)-4-amino-1-[[(2S,3R)-1,3-dihydroxy-1-oxobutan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-1-oxohexan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: (4S)-4-amino-5-[[(2S,3R)-1-[[(2S,3S)-1-[[(2S)-6-amino-1-[[(2S,3R)-1-[[(2S)-4-amino-1-[[(2S,3R)-1,3-dihydroxy-1-oxobutan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-1-oxohexan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-5-oxopentanoic acid Traditional Name: (4S)-4-amino-5-[[(1S,2R)-1-[[(1S,2S)-1-[[(1S)-5-amino-1-[[(1S,2R)-1-[[(1S)-3-amino-1-[[(1S,2R)-1-carboxy-2-hydroxy-propyl]carbamoyl]-3-keto-propyl]carbamoyl]-2-hydroxy-propyl]carbamoyl]pentyl]carbamoyl]-2-methyl-butyl]carbamoyl]-2-hydroxy-propyl]amino]-5-keto-valeric acid Formula: C33H59N9O14 MolecularWeight: 805.87346

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CCCCN)C(=O)NC(C(C)O)C(=O)NC(CC(=O)N)C(=O)NC(C(C)O)C(=O)O)NC(=O)C(C(C)O)NC(=O)C(CCC(=O)O)N

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H]([C@@H](C)O)C(=O)O)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCC(=O)O)N

InChI

InChI=1S/C33H59N9O14/c1-6-14(2)23(39-32(54)25(16(4)44)40-27(49)18(35)10-11-22(47)48)30(52)37-19(9-7-8-12-34)28(50)41-24(15(3)43)31(53)38-20(13-21(36)46)29(51)42-26(17(5)45)33(55)56/h14-20,23-26,43-45H,6-13,34-35H2,1-5H3,(H2,36,46)(H,37,52)(H,38,53)(H,39,54)(H,40,49)(H,41,50)(H,42,51)(H,47,48)(H,55,56)/t14-,15+,16+,17+,18-,19-,20-,23-,24-,25-,26-/m0/s1