2-[[(2S)-2-[[(2R)-5-[bis(azanyl)methylideneamino]-2-[[(2S)-2-[bis(azanyl)methylideneamino]-3-(4-hydroxyphenyl)propanoyl]amino]pentanoyl]amino]-3-phenyl-propanoyl]amino]-2-methyl-propanoic acid

Systemtic Name: 2-[[(2S)-2-[[(2R)-5-[bis(azanyl)methylideneamino]-2-[[(2S)-2-[bis(azanyl)methylideneamino]-3-(4-hydroxyphenyl)propanoyl]amino]pentanoyl]amino]-3-phenyl-propanoyl]amino]-2-methyl-propanoic acid Openeye Name: 2-[[(2S)-2-[[(2R)-5-guanidino-2-[[(2S)-2-guanidino-3-(4-hydroxyphenyl)propanoyl]amino]pentanoyl]amino]-3-phenyl-propanoyl]amino]-2-methyl-propanoic acid CAS Name: 2-[[(2S)-2-[[(2R)-5-(diaminomethylideneamino)-2-[[(2S)-2-(diaminomethylideneamino)-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxopentyl]amino]-1-oxo-3-phenylpropyl]amino]-2-methylpropanoic acid IUPAC Name: 2-[[(2S)-2-[[(2R)-5-(diaminomethylideneamino)-2-[[(2S)-2-(diaminomethylideneamino)-3-(4-hydroxyphenyl)propanoyl]amino]pentanoyl]amino]-3-phenylpropanoyl]amino]-2-methylpropanoic acid Traditional Name: 2-[[(2S)-2-[[(2R)-5-guanidino-2-[[(2S)-2-guanidino-3-(4-hydroxyphenyl)propanoyl]amino]pentanoyl]amino]-3-phenyl-propanoyl]amino]-2-methyl-propionic acid Formula: C29H41N9O6 MolecularWeight: 611.69254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)NC(=O)C(CC1=CC=CC=C1)NC(=O)C(CCCN=C(N)N)NC(=O)C(CC2=CC=C(C=C2)O)N=C(N)N

Isomeric SMILES

CC(C)(C(=O)O)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](CC2=CC=C(C=C2)O)N=C(N)N

InChI

InChI=1S/C29H41N9O6/c1-29(2,26(43)44)38-25(42)22(15-17-7-4-3-5-8-17)36-23(40)20(9-6-14-34-27(30)31)35-24(41)21(37-28(32)33)16-18-10-12-19(39)13-11-18/h3-5,7-8,10-13,20-22,39H,6,9,14-16H2,1-2H3,(H,35,41)(H,36,40)(H,38,42)(H,43,44)(H4,30,31,34)(H4,32,33,37)/t20-,21+,22+/m1/s1