化学式

CAS号

IUPAC Name

N-[[(2R,5S)-5-[2-[[(2R)-1-[[5-(carbamoylamino)-1-[4-[2-(chloroamino)乙基]苯胺基]-1-oxopentan-2-基]氨基]-1-氧代-3-苯基-2-基]氨基]-2-氧代乙基]-3,4-dihydroxyoxolan-2-基]甲基]-6-(2,5-dioxopyrrol-1-基)己酰胺 N-[[(2R,5S)-5-[2-[[(2R)-1-[[5-(carbamoylamino)-1-[4-[2-(chloroamino)ethyl]anilino]-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]-3,4-dihydroxyoxolan-2-yl]methyl]-6-(2,5-dioxopyrrol-1-yl)hexanamide

InChI

InChI=1S/C40H53ClN8O10/c41-45-20-18-25-12-14-27(15-13-25)46-38(56)28(10-7-19-43-40(42)58)48-39(57)29(22-26-8-3-1-4-9-26)47-33(51)23-30-36(54)37(55)31(59-30)24-44-32(50)11-5-2-6-21-49-34(52)16-17-35(49)53/h1,3-4,8-9,12-17,28-31,36-37,45,54-55H,2,5-7,10-11,18-24H2,(H,44,50)(H,46,56)(H,47,51)(H,48,57)(H3,42,43,58)/t28?,29-,30+,31-,36?,37?/m1/s1

InChI Key

XGLOEMGZJOSWSY-OWLGGWOYSA-N

Canonical SMILES

C1=CC=C(C=C1)CC(C(=O)NC(CCCNC(=O)N)C(=O)NC2=CC=C(C=C2)CCNCl)NC(=O)CC3C(C(C(O3)CNC(=O)CCCCCN4C(=O)C=CC4=O)O)O

别名

• SCHEMBL18820199