(2S)-2-[[(2S)-1-(benzenesulfonyl)pyrrolidine-2-carbonyl]amino]-3-[4-[[3-[[2-[4-[(2-methylphenyl)carbamoylamino]phenyl]acetyl]amino]pyrrolidine-1-carbonyl]amino]phenyl]propanoic acid
Molecular Formula:
C41H45N7O8S
InChI: InChI=1/C41H45N7O8S/c1-27-8-5-6-11-34(27)46-40(53)43-30-17-15-29(16-18-30)25-37(49)42-32-21-23-47(26-32)41(54)44-31-19-13-28(14-20-31)24-35(39(51)52)45-38(50)36-12-7-22-48(36)57(55,56)33-9-3-2-4-10-33/h2-6,8-11,13-20,32,35-36H,7,12,21-26H2,1H3,(H,42,49)(H,44,54)(H,45,50)(H,51,52)(H2,43,46,53)/t32?,35-,36-/m0/s1/f/h42-46,51H
InChIKey: InChIKey=UGYKYUBRWCUWHW-VFVLYULXDP
SMILES: CC1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)CC(=O)NC3CCN(C3)C(=O)NC4=CC=C(C=C4)CC(C(=O)O)NC(=O)C5CCCN5S(=O)(=O)C6=CC=CC=C6
Names:
(2S)-2-[[(2S)-1-(benzenesulfonyl)pyrrolidine-2-carbonyl]amino]-3-[4-[[3-[[2-[4-[(2-methylphenyl)carbamoylamino]phenyl]acetyl]amino]pyrrolidine-1-carbonyl]amino]phenyl]propanoic acid
Registries:
PubChem CID 9918750
PubChem ID 14889215
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