(2S)-N-[2-[[(2S)-1-[[(2S)-1-[[(2R)-1-[[1-[[(2S)-1-azanyl-5-[bis(azanyl)methylideneamino]-1-oxidanylidene-pentan-2-yl]amino]-3,3-dimethyl-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-2-oxidanylidene-ethyl]-1-[(2S)-1-[(2S)-2-azanyl-5-[bis(azanyl)methylideneamino]pentanoyl]pyrrolidin-2-yl]carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[2-[[(2S)-1-[[(2S)-1-[[(2R)-1-[[1-[[(2S)-1-azanyl-5-[bis(azanyl)methylideneamino]-1-oxidanylidene-pentan-2-yl]amino]-3,3-dimethyl-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-2-oxidanylidene-ethyl]-1-[(2S)-1-[(2S)-2-azanyl-5-[bis(azanyl)methylideneamino]pentanoyl]pyrrolidin-2-yl]carbonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-1-[(2S)-1-[(2S)-2-amino-5-guanidino-pentanoyl]pyrrolidine-2-carbonyl]-N-[2-[[(1S)-1-benzyl-2-[[(1S)-2-[[(1R)-1-benzyl-2-[[1-[[(1S)-1-carbamoyl-4-guanidino-butyl]carbamoyl]-2,2-dimethyl-propyl]amino]-2-oxo-ethyl]amino]-1-(hydroxymethyl)-2-oxo-ethyl]amino]-2-oxo-ethyl]amino]-2-oxo-ethyl]pyrrolidine-2-carboxamide CAS Name: (2S)-N-[2-[[(2S)-1-[[(2S)-1-[[(2R)-1-[[1-[[(2S)-1-amino-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-3,3-dimethyl-1-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]-1-[[(2S)-1-[(2S)-2-amino-5-(diaminomethylideneamino)-1-oxopentyl]-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[2-[[(2S)-1-[[(2S)-1-[[(2R)-1-[[1-[[(2S)-1-amino-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-3,3-dimethyl-1-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]-1-[(2S)-1-[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-1-[(2S)-1-[(2S)-2-amino-5-guanidino-pentanoyl]prolyl]-N-[2-[[(1S)-1-benzyl-2-[[(1S)-2-[[(1R)-1-benzyl-2-[[1-[[(1S)-1-carbamoyl-4-guanidino-butyl]carbamoyl]-2,2-dimethyl-propyl]amino]-2-keto-ethyl]amino]-2-keto-1-methylol-ethyl]amino]-2-keto-ethyl]amino]-2-keto-ethyl]pyrrolidine-2-carboxamide Formula: C51H78N16O10 MolecularWeight: 1075.26622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)NC(CCCN=C(N)N)C(=O)N)NC(=O)C(CC1=CC=CC=C1)NC(=O)C(CO)NC(=O)C(CC2=CC=CC=C2)NC(=O)CNC(=O)C3CCCN3C(=O)C4CCCN4C(=O)C(CCCN=C(N)N)N

Isomeric SMILES

CC(C)(C)C(C(=O)N[C@@H](CCCN=C(N)N)C(=O)N)NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](CO)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)CNC(=O)[C@@H]3CCCN3C(=O)[C@@H]4CCCN4C(=O)[C@H](CCCN=C(N)N)N

InChI

InChI=1S/C51H78N16O10/c1-51(2,3)40(46(75)62-33(41(53)70)19-11-23-59-50(56)57)65-43(72)35(27-31-16-8-5-9-17-31)63-44(73)36(29-68)64-42(71)34(26-30-14-6-4-7-15-30)61-39(69)28-60-45(74)37-20-12-24-66(37)48(77)38-21-13-25-67(38)47(76)32(52)18-10-22-58-49(54)55/h4-9,14-17,32-38,40,68H,10-13,18-29,52H2,1-3H3,(H2,53,70)(H,60,74)(H,61,69)(H,62,75)(H,63,73)(H,64,71)(H,65,72)(H4,54,55,58)(H4,56,57,59)/t32-,33-,34-,35+,36-,37-,38-,40?/m0/s1