Nsc699055

Structural Information

Molecular Formula

C₉₀H₁₅₁N₁₅O₂₁S

SMILES

CCC1C(=O)N(C(C(=O)N(C(C(=O)NC(C(=O)N(C(C(=O)NC(C(=O)NC(C(=O)N(C(C(=O)N(C(C(=O)N(C(C(=O)N(C(C(=O)N1)C(C(C)C)O)C)C(C)C)C)CC(C)C)C)CC(C)C)C)C)CCCCNC(=O)COC2=CC=C(C=C2)CC(C(CN(CC(C)C)S(=O)(=O)C3=CC=C(C=C3)N)O)NC(=O)OC4CCOC4)CC(C)C)C)C(C)C)CC(C)C)C)CO)C

InChI

InChI=1S/C90H151N15O21S/c1-26-65-84(115)102(23)72(48-106)87(118)98(19)69(42-52(4)5)81(112)97-75(56(12)13)88(119)99(20)68(41-51(2)3)80(111)95-66(79(110)93-59(18)83(114)100(21)70(43-53(6)7)85(116)101(22)71(44-54(8)9)86(117)103(24)76(57(14)15)89(120)104(25)77(82(113)94-65)78(109)58(16)17)29-27-28-39-92-74(108)50-125-62-34-30-60(31-35-62)45-67(96-90(121)126-63-38-40-124-49-63)73(107)47-105(46-55(10)11)127(122,123)64-36-32-61(91)33-37-64/h30-37,51-59,63,65-73,75-78,106-107,109H,26-29,38-50,91H2,1-25H3,(H,92,108)(H,93,110)(H,94,113)(H,95,111)(H,96,121)(H,97,112)

InChIKey

HVOLPPOWVIAIMC-UHFFFAOYSA-N

Compound name

oxolan-3-yl N-[4-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-1-[4-[2-[4-[20-ethyl-23-(hydroxymethyl)-17-(1-hydroxy-2-methylpropyl)-5,7,10,13,16,22,25,31-octamethyl-8,11,26,32-tetrakis(2-methylpropyl)-3,6,9,12,15,18,21,24,27,30,33-undecaoxo-14,29-di(propan-2-yl)-1,4,7,10,13,16,19,22,25,28,31-undecazacyclotritriacont-2-yl]butylamino]-2-oxoethoxy]phenyl]-3-hydroxybutan-2-yl]carbamate

Related CIDs

• CID 496782