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

Catalog ID
STL545559
SMILES CSCC[C@@H](C(=O)N1CCC(CC1)C(=O)O)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 C32H41N3O8S MW 627.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H41N3O8S/c1-18(36)33-23-8-6-20-16-27(41-2)29(42-3)30(43-4)28(20)21-7-9-24(26(37)17-22(21)23)34-25(12-15-44-5)31(38)35-13-10-19(11-14-35)32(39)40/h7,9,16-17,19,23,25H,6,8,10-15H2,1-5H3,(H,33,36)(H,34,37)(H,39,40)/t23-,25-/m0/s1
InChIKey
RYZJVSUMDZOCQO-ZCYQVOJMSA-N
Synonyms

1((2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)4methylsulfanylbutanoyl)piperidine4carboxylicacid
1((S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)4(methylthio)butanoyl)piperidine4carboxylicacid
1(N((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)Lmethionyl)piperidine4carboxylicacid
110206400
CSCC(C@@H)(C(=O)N1CCC(CC1)C(=O)O)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC32H41N3O8Sc118(36)332386201627(412)29(423)30(434)28(20)217924(26(37)1722(21)23)3425(1215445)31(38)35131019(111435)32(39)40h791617192325H681015H215H3(H3336)(H3437)(H3940)t2325m0s1
ZINC000253412774
ZINC253412774

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.

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