Vitas-M small molecule compound
N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-cycloheptyl-L-methioninamide
Catalog ID
STL545551
SMILES CSCC[C@@H](C(=O)NC1CCCCCC1)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 C33H45N3O6S MW 611.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H45N3O6S/c1-20(37)34-25-14-12-21-18-29(40-2)31(41-3)32(42-4)30(21)23-13-15-26(28(38)19-24(23)25)36-27(16-17-43-5)33(39)35-22-10-8-6-7-9-11-22/h13,15,18-19,22,25,27H,6-12,14,16-17H2,1-5H3,(H,34,37)(H,35,39)(H,36,38)/t25-,27-/m0/s1InChIKey
RGPFLHXWCOPWRZ-BDYUSTAISA-NSynonyms
1574354-58-7(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)cycloheptyl4methylsulfanylbutanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)Ncycloheptyl4(methylthio)butanamide
1574354587
75491809
CSCC(C@@H)(C(=O)NC1CCCCCC1)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC33H45N3O6Sc120(37)34251412211829(402)31(413)32(424)30(21)23131526(28(38)1924(23)25)3627(1617435)33(39)35221086791122h13151819222527H612141617H215H3(H3437)(H3539)(H3638)t2527m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)NcycloheptylLmethioninamide
ZINC000108449603
ZINC108449603
Check stock
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Check stock on Vitas-MAvailable files
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