Kkkklllptlvff

Structural Information

Molecular Formula

C₈₀H₁₃₅N₁₇O₁₅

SMILES

C[C@H]([C@@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)O)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)N)O

InChI

InChI=1S/C80H135N17O15/c1-47(2)41-59(89-71(102)58(34-21-25-39-84)88-70(101)57(33-20-24-38-83)87-69(100)56(32-19-23-37-82)86-68(99)55(85)31-18-22-36-81)72(103)90-60(42-48(3)4)73(104)93-63(44-50(7)8)79(110)97-40-26-35-65(97)76(107)96-67(52(11)98)78(109)91-61(43-49(5)6)75(106)95-66(51(9)10)77(108)92-62(45-53-27-14-12-15-28-53)74(105)94-64(80(111)112)46-54-29-16-13-17-30-54/h12-17,27-30,47-52,55-67,98H,18-26,31-46,81-85H2,1-11H3,(H,86,99)(H,87,100)(H,88,101)(H,89,102)(H,90,103)(H,91,109)(H,92,108)(H,93,104)(H,94,105)(H,95,106)(H,96,107)(H,111,112)/t52-,55+,56+,57+,58+,59+,60+,61+,62+,63+,64+,65+,66+,67+/m1/s1

InChIKey

WKUIYFRGDYCWGQ-DFLCWXDNSA-N

Compound name

(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2,6-diaminohexanoyl]amino]hexanoyl]amino]hexanoyl]amino]hexanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-3-hydroxybutanoyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoyl]amino]-3-phenylpropanoyl]amino]-3-phenylpropanoic acid

Related CIDs

• CID 16073111