(2S)-2-[2-[[(2S)-2-[[(2S,3R)-2-azanyl-3-oxidanyl-butanoyl]amino]-5-[bis(azanyl)methylideneamino]pentanoyl]amino]ethanoylamino]-4-methyl-N-[(2S)-3-methyl-1-oxidanylidene-butan-2-yl]pentanamide

Systemtic Name: (2S)-2-[2-[[(2S)-2-[[(2S,3R)-2-azanyl-3-oxidanyl-butanoyl]amino]-5-[bis(azanyl)methylideneamino]pentanoyl]amino]ethanoylamino]-4-methyl-N-[(2S)-3-methyl-1-oxidanylidene-butan-2-yl]pentanamide Openeye Name: (2S)-2-[[2-[[(2S)-2-[[(2S,3R)-2-amino-3-hydroxy-butanoyl]amino]-5-guanidino-pentanoyl]amino]acetyl]amino]-N-[(1S)-1-formyl-2-methyl-propyl]-4-methyl-pentanamide CAS Name: (2S)-2-[[2-[[(2S)-2-[[(2S,3R)-2-amino-3-hydroxy-1-oxobutyl]amino]-5-(diaminomethylideneamino)-1-oxopentyl]amino]-1-oxoethyl]amino]-4-methyl-N-[(2S)-3-methyl-1-oxobutan-2-yl]pentanamide IUPAC Name: (2S)-2-[[2-[[(2S)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]amino]-4-methyl-N-[(2S)-3-methyl-1-oxobutan-2-yl]pentanamide Traditional Name: (2S)-2-[[2-[[(2S)-2-[[(2S,3R)-2-amino-3-hydroxy-butanoyl]amino]-5-guanidino-pentanoyl]amino]acetyl]amino]-N-[(1S)-1-formyl-2-methyl-propyl]-4-methyl-valeramide Formula: C23H44N8O6 MolecularWeight: 528.64546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H44N8O6/c1-12(2)9-16(21(36)31-17(11-32)13(3)4)29-18(34)10-28-20(35)15(7-6-8-27-23(25)26)30-22(37)19(24)14(5)33/h11-17,19,33H,6-10,24H2,1-5H3,(H,28,35)(H,29,34)(H,30,37)(H,31,36)(H4,25,26,27)/t14-,15+,16+,17-,19+/m1/s1