2-[2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-(2-azanylethanoylamino)ethanoylamino]-5-[bis(azanyl)methylideneamino]pentanoyl]amino]ethanoylamino]-5-[bis(azanyl)methylideneamino]pentanoyl]amino]-5-[bis(azanyl)methylideneamino]pentanoyl]amino]ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[2-(2-azanylethanoylamino)ethanoylamino]-5-[bis(azanyl)methylideneamino]pentanoyl]amino]ethanoylamino]-5-[bis(azanyl)methylideneamino]pentanoyl]amino]-5-[bis(azanyl)methylideneamino]pentanoyl]amino]ethanoylamino]ethanoic acid Openeye Name: 2-[[2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-[[2-[(2-aminoacetyl)amino]acetyl]amino]-5-guanidino-pentanoyl]amino]acetyl]amino]-5-guanidino-pentanoyl]amino]-5-guanidino-pentanoyl]amino]acetyl]amino]acetic acid CAS Name: 2-[[2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-[[2-[(2-amino-1-oxoethyl)amino]-1-oxoethyl]amino]-5-(diaminomethylideneamino)-1-oxopentyl]amino]-1-oxoethyl]amino]-5-(diaminomethylideneamino)-1-oxopentyl]amino]-5-(diaminomethylideneamino)-1-oxopentyl]amino]-1-oxoethyl]amino]acetic acid IUPAC Name: 2-[[2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-[[2-[(2-aminoacetyl)amino]acetyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]amino]acetic acid Traditional Name: 2-[[2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-[[2-(glycylamino)acetyl]amino]-5-guanidino-pentanoyl]amino]acetyl]amino]-5-guanidino-pentanoyl]amino]-5-guanidino-pentanoyl]amino]acetyl]amino]acetic acid Formula: C28H53N17O9 MolecularWeight: 771.82892

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(C(=O)NCC(=O)NC(CCCN=C(N)N)C(=O)NC(CCCN=C(N)N)C(=O)NCC(=O)NCC(=O)O)NC(=O)CNC(=O)CN)CN=C(N)N

Isomeric SMILES

C(C[C@@H](C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(=O)NCC(=O)O)NC(=O)CNC(=O)CN)CN=C(N)N

InChI

InChI=1S/C28H53N17O9/c29-10-18(46)39-12-20(48)43-15(4-1-7-36-26(30)31)23(52)42-13-21(49)44-17(6-3-9-38-28(34)35)25(54)45-16(5-2-8-37-27(32)33)24(53)41-11-19(47)40-14-22(50)51/h15-17H,1-14,29H2,(H,39,46)(H,40,47)(H,41,53)(H,42,52)(H,43,48)(H,44,49)(H,45,54)(H,50,51)(H4,30,31,36)(H4,32,33,37)(H4,34,35,38)/t15-,16-,17-/m0/s1