(2S)-5-azanyl-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-6-azanyl-2-[[(2S)-4-azanyl-2-[[(2S)-2-azanyl-3-phenyl-propanoyl]amino]-4-oxidanylidene-butanoyl]amino]hexanoyl]amino]propanoyl]amino]-3-methyl-pentanoyl]amino]-3-oxidanyl-propanoyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-5-azanyl-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-6-azanyl-2-[[(2S)-4-azanyl-2-[[(2S)-2-azanyl-3-phenyl-propanoyl]amino]-4-oxidanylidene-butanoyl]amino]hexanoyl]amino]propanoyl]amino]-3-methyl-pentanoyl]amino]-3-oxidanyl-propanoyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-5-amino-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-4-amino-2-[[(2S)-2-amino-3-phenyl-propanoyl]amino]-4-oxo-butanoyl]amino]hexanoyl]amino]propanoyl]amino]-3-methyl-pentanoyl]amino]-3-hydroxy-propanoyl]amino]-5-oxo-pentanoic acid CAS Name: (2S)-5-amino-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-4-amino-2-[[(2S)-2-amino-1-oxo-3-phenylpropyl]amino]-1,4-dioxobutyl]amino]-1-oxohexyl]amino]-1-oxopropyl]amino]-3-methyl-1-oxopentyl]amino]-3-hydroxy-1-oxopropyl]amino]-5-oxopentanoic acid IUPAC Name: (2S)-5-amino-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-4-amino-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-4-oxobutanoyl]amino]hexanoyl]amino]propanoyl]amino]-3-methylpentanoyl]amino]-3-hydroxypropanoyl]amino]-5-oxopentanoic acid Traditional Name: (2S)-5-amino-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-4-amino-2-[[(2S)-2-amino-3-phenyl-propanoyl]amino]-4-keto-butanoyl]amino]hexanoyl]amino]propanoyl]amino]-3-methyl-pentanoyl]amino]-3-hydroxy-propanoyl]amino]-5-keto-valeric acid Formula: C36H58N10O11 MolecularWeight: 806.90612

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CO)C(=O)NC(CCC(=O)N)C(=O)O)NC(=O)C(C)NC(=O)C(CCCCN)NC(=O)C(CC(=O)N)NC(=O)C(CC1=CC=CC=C1)N

Isomeric SMILES

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

InChI

InChI=1S/C36H58N10O11/c1-4-19(2)29(35(55)45-26(18-47)34(54)43-24(36(56)57)13-14-27(39)48)46-30(50)20(3)41-32(52)23(12-8-9-15-37)42-33(53)25(17-28(40)49)44-31(51)22(38)16-21-10-6-5-7-11-21/h5-7,10-11,19-20,22-26,29,47H,4,8-9,12-18,37-38H2,1-3H3,(H2,39,48)(H2,40,49)(H,41,52)(H,42,53)(H,43,54)(H,44,51)(H,45,55)(H,46,50)(H,56,57)/t19-,20-,22-,23-,24-,25-,26-,29-/m0/s1