(2R,3S)-2-acetamido-N-[(2S,3R)-1-[[(2S)-1-[[(2S,3S)-1-[[(2S)-5-[bis(azanyl)methylideneamino]-1-(ethylamino)-1-oxidanylidene-pentan-2-yl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]-3-methyl-pentanamide

Systemtic Name: (2R,3S)-2-acetamido-N-[(2S,3R)-1-[[(2S)-1-[[(2S,3S)-1-[[(2S)-5-[bis(azanyl)methylideneamino]-1-(ethylamino)-1-oxidanylidene-pentan-2-yl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]-3-methyl-pentanamide Openeye Name: (2R,3S)-2-acetamido-N-[(1S,2R)-1-[[(1S)-2-[[(1S,2S)-1-[[(1S)-1-(ethylcarbamoyl)-4-guanidino-butyl]carbamoyl]-2-methyl-butyl]amino]-1-(hydroxymethyl)-2-oxo-ethyl]carbamoyl]-2-hydroxy-propyl]-3-methyl-pentanamide CAS Name: (2R,3S)-2-acetamido-N-[(2S,3R)-1-[[(2S)-1-[[(2S,3S)-1-[[(2S)-5-(diaminomethylideneamino)-1-(ethylamino)-1-oxopentan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]-3-methylpentanamide IUPAC Name: (2R,3S)-2-acetamido-N-[(2S,3R)-1-[[(2S)-1-[[(2S,3S)-1-[[(2S)-5-(diaminomethylideneamino)-1-(ethylamino)-1-oxopentan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]-3-methylpentanamide Traditional Name: (2R,3S)-2-acetamido-N-[(1S,2R)-1-[[(1S)-2-[[(1S,2S)-1-[[(1S)-1-(ethylcarbamoyl)-4-guanidino-butyl]carbamoyl]-2-methyl-butyl]amino]-2-keto-1-methylol-ethyl]carbamoyl]-2-hydroxy-propyl]-3-methyl-valeramide Formula: C29H55N9O8 MolecularWeight: 657.8025

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(C(C)O)C(=O)NC(CO)C(=O)NC(C(C)CC)C(=O)NC(CCCN=C(N)N)C(=O)NCC)NC(=O)C

Isomeric SMILES

CC[C@H](C)[C@H](C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC)NC(=O)C

InChI

InChI=1S/C29H55N9O8/c1-8-15(4)21(34-18(7)41)27(45)38-23(17(6)40)28(46)36-20(14-39)25(43)37-22(16(5)9-2)26(44)35-19(24(42)32-10-3)12-11-13-33-29(30)31/h15-17,19-23,39-40H,8-14H2,1-7H3,(H,32,42)(H,34,41)(H,35,44)(H,36,46)(H,37,43)(H,38,45)(H4,30,31,33)/t15-,16-,17+,19-,20-,21+,22-,23-/m0/s1