ICI 174,864   Click here for help

GtoPdb Ligand ID: 1636

Synonyms: ICI-174,864 | ICI-174864
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2D Structure
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SMILES / InChI / InChIKey
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Canonical SMILES C=CCN(C(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)O)CC(C)C)Cc1ccccc1)(C)C)Cc1ccc(cc1)O)CC=C
Isomeric SMILES C=CCN([C@H](C(=O)NC(C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)Cc1ccccc1)(C)C)Cc1ccc(cc1)O)CC=C
InChI InChI=1S/C34H46N4O6/c1-7-18-38(19-8-2)29(22-25-14-16-26(39)17-15-25)31(41)37-34(5,6)33(44)36-27(21-24-12-10-9-11-13-24)30(40)35-28(32(42)43)20-23(3)4/h7-17,23,27-29,39H,1-2,18-22H2,3-6H3,(H,35,40)(H,36,44)(H,37,41)(H,42,43)/t27-,28-,29-/m0/s1
InChI Key BGJPRBZZLWCLJW-AWCRTANDSA-N
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Compound class Peptide or derivative
IUPAC Name Click here for help
(2S)-2-[[(2S)-2-[[2-[[(2S)-2-(di(prop-2-enyl)amino)-3-(4-hydroxyphenyl)propanoyl]amino]-2-methylpropanoyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoic acid
Synonyms Click here for help
ICI-174,864 | ICI-174864
Database Links Click here for help
CAS Registry No. 89352-67-0 (source: Scifinder)
GtoPdb PubChem SID 135650369
PubChem CID 107691
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