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3-({N-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-L-methionyl}amino)-4-methoxy-N-methylbenzamide

Catalog ID
STL546901
SMILES CSCC[C@@H](C(=O)Nc1cc(ccc1OC)C(=O)NC)Nc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C35H42N4O8S MW 678.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H42N4O8S/c1-19(40)37-24-11-8-20-17-30(45-4)32(46-5)33(47-6)31(20)22-10-12-25(28(41)18-23(22)24)38-26(14-15-48-7)35(43)39-27-16-21(34(42)36-2)9-13-29(27)44-3/h9-10,12-13,16-18,24,26H,8,11,14-15H2,1-7H3,(H,36,42)(H,37,40)(H,38,41)(H,39,43)/t24-,
InChIKey
NSZHWVXLSWXNJT-AHWVRZQESA-N
Synonyms

121541238
3(((2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)4methylsulfanylbutanoyl)amino)4methoxy~(N)methylbenzamide
3((N((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)Lmethionyl)amino)4methoxyNmethylbenzamide
3((S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)4(methylthio)butanamido)4methoxyNmethylbenzamide
CSCC(C@@H)(C(=O)Nc1cc(ccc1OC)C(=O)NC)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC35H42N4O8Sc119(40)3724118201730(454)32(465)33(476)31(20)22101225(28(41)1823(22)24)3826(1415487)35(43)39271621(34(42)362)91329(27)443h910121316182426H8111415H217H3(H3642)(H3740)(H3841)(H3943)t2426m0s1
ZINC000263585909
ZINC263585909

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Available files

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