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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)NCCCC(=O)O)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/c30-28(31)35-15-4-8-21(36-27(44)23(38-29(32)33)17-19-10-12-20(39)13-11-19)26(43)37-22(16-18-6-2-1-3-7-18)25(42)34-14-5-9-24(40)41/h1-3,6-7,10-13,21-23,39H,4-5,8-9,14-17H2,(H,34,42)(H,36,44)(H,37,43)(H,40,41)(H4,30,31,35)(H4,32,33,38)/t21-,22+,23+/m1/s1