Catalog Number:
AG0052SX
Chemical Name:
L-Phenylalanine, L-cysteinyl-L-isoleucyl-L-glutaminyl-L-isoleucyl-L-histidyl-
CAS Number:
855399-24-5
Molecular Formula:
C35H53N9O8S
Molecular Weight:
759.9158
IUPAC Name:
(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-5-amino-2-[[(2S,3S)-2-[[(2R)-2-amino-3-sulfanylpropanoyl]amino]-3-methylpentanoyl]amino]-5-oxopentanoyl]amino]-3-methylpentanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-3-phenylpropanoic acid
InChI:
InChI=1S/C35H53N9O8S/c1-5-19(3)28(43-30(46)23(36)17-53)33(49)40-24(12-13-27(37)45)31(47)44-29(20(4)6-2)34(50)41-25(15-22-16-38-18-39-22)32(48)42-26(35(51)52)14-21-10-8-7-9-11-21/h7-11,16,18-20,23-26,28-29,53H,5-6,12-15,17,36H2,1-4H3,(H2,37,45)(H,38,39)(H,40,49)(H,41,50)(H,42,48)(H,43,46)(H,44,47)(H,51,52)/t19-,20-,23-,24-,25-,26-,28-,29-/m0/s1
InChI Key:
CYLOXKUSGJCXQL-YZAQWZMYSA-N
SMILES:
CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](CS)N)CCC(=O)N)C