CC[C@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(Cc1ccccc1)C(=O)O)[C@H](C)OCc1ccccc1)c1ccccc1

名称: N-benzyloxycarbonyl-β-benzyl-L-aspartyl-O-benzyl-D-threonine (S)-α-ethylbenzylamide

IUPAC: (3S)-2-benzyl-4-oxo-4-[[(2R,3S)-1-oxo-3-phenylmethoxy-1-[[(1S)-1-phenylpropyl]amino]butan-2-yl]amino]-3-(phenylmethoxycarbonylamino)butanoic acid

SMILES: CC[C@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(Cc1ccccc1)C(=O)O)[C@H](C)OCc1ccccc1)c1ccccc1

Canonical SMILES: CCC(C1=CC=CC=C1)NC(=O)C(C(C)OCC2=CC=CC=C2)NC(=O)C(C(CC3=CC=CC=C3)C(=O)O)NC(=O)OCC4=CC=CC=C4

分子式: C39H43N3O7

分子量: 665.80

InChIKey: LXDQKSZIZDYFDS-FMLONVOMSA-N

InChI:

InChI=1S/C39H43N3O7/c1-3-33(31-22-14-7-15-23-31)40-36(43)34(27(2)48-25-29-18-10-5-11-19-29)41-37(44)35(32(38(45)46)24-28-16-8-4-9-17-28)42-39(47)49-26-30-20-12-6-13-21-30/h4-23,27,32-35H,3,24-26H2,1-2H3,(H,40,43)(H,41,44)(H,42,47)(H,45,46)/t27-,32?,33-,34+,35-/m0/s1

PubChem CID: 54057312 →

同义词

SCHEMBL7757905LXDQKSZIZDYFDS-FMLONVOMSA-NN-benzyloxycarbonyl-beta-benzyl-L-aspartyl-O-benzyl-D-threonine (S)-alpha-ethylbenzylamide

参与 1 个反应→