化学式

CAS号

IUPAC Name

(2R)-N-[(3S,6S,10S,11R,14S,15R,18S,21S)-11-[(2S)-丁-2-基]-10-羟基-18-[(4-甲氧基苯基)甲基]-15,19-二甲基-3-(2-甲基丙基)-2,5,8,13,17,20-hexaoxo-6-丙烷-2-基-7,16-二氧杂-1,4,12,19-tetrazabicyclo[19.3.0]tetracosan-14-基]-2-[[(2S)-2-(chloroamino)-3-甲基丁酰基]-甲基氨基]-4-甲基戊酰胺 (2R)-N-[(3S,6S,10S,11R,14S,15R,18S,21S)-11-[(2S)-butan-2-yl]-10-hydroxy-18-[(4-methoxyphenyl)methyl]-15,19-dimethyl-3-(2-methylpropyl)-2,5,8,13,17,20-hexaoxo-6-propan-2-yl-7,16-dioxa-1,4,12,19-tetrazabicyclo[19.3.0]tetracosan-14-yl]-2-[[(2S)-2-(chloroamino)-3-methylbutanoyl]-methylamino]-4-methylpentanamide

InChI

InChI=1S/C51H82ClN7O12/c1-15-31(10)42-39(60)26-40(61)71-44(30(8)9)47(64)53-35(23-27(2)3)48(65)59-22-16-17-36(59)49(66)58(13)38(25-33-18-20-34(69-14)21-19-33)51(68)70-32(11)43(46(63)54-42)55-45(62)37(24-28(4)5)57(12)50(67)41(56-52)29(6)7/h18-21,27-32,35-39,41-44,56,60H,15-17,22-26H2,1-14H3,(H,53,64)(H,54,63)(H,55,62)/t31-,32+,35-,36-,37+,38-,39-,41-,42+,43-,44-/m0/s1

InChI Key

MWSJAPLPMWTVDG-RQQWHTIBSA-N

Canonical SMILES

CCC(C)C1C(CC(=O)OC(C(=O)NC(C(=O)N2CCCC2C(=O)N(C(C(=O)OC(C(C(=O)N1)NC(=O)C(CC(C)C)N(C)C(=O)C(C(C)C)NCl)C)CC3=CC=C(C=C3)OC)C)CC(C)C)C(C)C)O

别名

• SCHEMBL13413539