化学式

CAS号

IUPAC Name

[3-氯-4-[[(2S)-6-(chloroamino)-2-[[(2S)-2-[[(2R)-2-(chloroamino)丙酰基]氨基]-3-phenylpropanoyl]氨基]hexanoyl]氨基]苯基]甲基N-[(2S,3S,4S,6R)-3-羟基-2-甲基-6-[[(1S,3S)-3,5,12-三羟基-3-(2-羟基乙酰基)-10-甲氧基-6,11-二氧代-2,4-二氢-1H-tetracen-1-基]氧基]四氢吡喃-4-基]氨基甲酯 [3-chloro-4-[[(2S)-6-(chloroamino)-2-[[(2S)-2-[[(2R)-2-(chloroamino)propanoyl]amino]-3-phenylpropanoyl]amino]hexanoyl]amino]phenyl]methyl N-[(2S,3S,4S,6R)-3-hydroxy-2-methyl-6-[[(1S,3S)-3,5,12-trihydroxy-3-(2-hydroxyacetyl)-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]oxan-4-yl]carbamate

InChI

InChI=1S/C53H59Cl3N6O16/c1-25(62-56)49(70)60-35(19-27-10-5-4-6-11-27)51(72)59-33(13-7-8-17-57-55)50(71)58-32-16-15-28(18-31(32)54)24-76-52(73)61-34-20-39(77-26(2)44(34)65)78-37-22-53(74,38(64)23-63)21-30-41(37)48(69)43-42(46(30)67)45(66)29-12-9-14-36(75-3)40(29)47(43)68/h4-6,9-12,14-16,18,25-26,33-35,37,39,44,57,62-63,65,67,69,74H,7-8,13,17,19-24H2,1-3H3,(H,58,71)(H,59,72)(H,60,70)(H,61,73)/t25-,26+,33+,34+,35+,37+,39+,44-,53+/m1/s1

InChI Key

BBCQBBOOKFFPFW-GJGRQZHXSA-N

Canonical SMILES

CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)CO)O)NC(=O)OCC6=CC(=C(C=C6)NC(=O)C(CCCCNCl)NC(=O)C(CC7=CC=CC=C7)NC(=O)C(C)NCl)Cl)O

别名