Ac-gln-ile-gly-met-thr-leu-asn-phe-nh2

Structural Information

Molecular Formula

C₄₃H₆₉N₁₁O₁₂S

SMILES

CC[C@H](C)[C@@H](C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N)NC(=O)[C@H](CCC(=O)N)NC(=O)C

InChI

InChI=1S/C43H69N11O12S/c1-8-23(4)35(53-38(61)27(48-25(6)56)14-15-32(44)57)42(65)47-21-34(59)49-28(16-17-67-7)39(62)54-36(24(5)55)43(66)52-30(18-22(2)3)40(63)51-31(20-33(45)58)41(64)50-29(37(46)60)19-26-12-10-9-11-13-26/h9-13,22-24,27-31,35-36,55H,8,14-21H2,1-7H3,(H2,44,57)(H2,45,58)(H2,46,60)(H,47,65)(H,48,56)(H,49,59)(H,50,64)(H,51,63)(H,52,66)(H,53,61)(H,54,62)/t23-,24+,27-,28-,29-,30-,31-,35-,36-/m0/s1

InChIKey

GUAQLGMWSUMNGX-QYUOUNJVSA-N

Compound name

(2S)-2-acetamido-N-[(2S,3S)-1-[[2-[[(2S)-1-[[(2S,3R)-1-[[(2S)-1-[[(2S)-4-amino-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]amino]-2-oxoethyl]amino]-3-methyl-1-oxopentan-2-yl]pentanediamide

Related CIDs

• CID 453507