CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H]1C(=O)NCc1cc(Cl)ccc1OCC(=O)O)C1CCCCC1

名称: [2-({[((2S)-1-{(2R)-2-[(tert-butoxycarbonyl) amino]-2-cyclohexylethanoyl} pyrrolidin-2-yl)carbonyl]amino} methyl)-4-chlorophenoxy]acetic acid

IUPAC: 2-[4-chloro-2-[[[(2S)-1-[(2R)-2-cyclohexyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetyl]pyrrolidine-2-carbonyl]amino]methyl]phenoxy]acetic acid

SMILES: CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H]1C(=O)NCc1cc(Cl)ccc1OCC(=O)O)C1CCCCC1

Canonical SMILES: CC(C)(C)OC(=O)NC(C1CCCCC1)C(=O)N2CCCC2C(=O)NCC3=C(C=CC(=C3)Cl)OCC(=O)O

分子式: C27H38ClN3O7

分子量: 552.10

InChIKey: AEBLDBSDFOICMZ-NZQKXSOJSA-N

InChI:

InChI=1S/C27H38ClN3O7/c1-27(2,3)38-26(36)30-23(17-8-5-4-6-9-17)25(35)31-13-7-10-20(31)24(34)29-15-18-14-19(28)11-12-21(18)37-16-22(32)33/h11-12,14,17,20,23H,4-10,13,15-16H2,1-3H3,(H,29,34)(H,30,36)(H,32,33)/t20-,23+/m0/s1

PubChem CID: 10745275 →

同義語

AEBLDBSDFOICMZ-NZQKXSOJSA-N[2-({[((2S)-1-{(2R)-2-[(tert-butoxycarbonyl) amino]-2-cyclohexylethanoyl} pyrrolidin-2-yl)carbonyl]amino} methyl)-4-chlorophenoxy]acetic acid

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