Ksl3

Structural Information

Molecular Formula

C₆₆H₁₁₄N₁₆O₁₀

SMILES

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

InChI

InChI=1S/C66H114N16O10/c1-42(2)37-52(62(88)76-51(31-17-22-36-71)61(87)81-55(40-45-23-9-7-10-24-45)65(91)74-48(57(73)83)28-14-19-33-68)78-60(86)50(30-16-21-35-70)77-66(92)56(41-46-25-11-8-12-26-46)82-64(90)54(39-44(5)6)80-63(89)53(38-43(3)4)79-59(85)49(29-15-20-34-69)75-58(84)47(72)27-13-18-32-67/h7-12,23-26,42-44,47-56H,13-22,27-41,67-72H2,1-6H3,(H2,73,83)(H,74,91)(H,75,84)(H,76,88)(H,77,92)(H,78,86)(H,79,85)(H,80,89)(H,81,87)(H,82,90)/t47-,48-,49-,50-,51-,52-,53-,54-,55-,56-/m0/s1

InChIKey

SBJKFZYCWPLROF-GXTUYBNASA-N

Compound name

(2S)-2,6-diamino-N-[(2S)-6-amino-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-6-amino-1-[[(2S)-1-[[(2S)-6-amino-1-[[(2S)-1-[[(2S)-1,6-diamino-1-oxohexan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxohexan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxohexan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxohexan-2-yl]hexanamide

Related CIDs

• CID 484128