Vitas-M small molecule compound
N-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-4-chlorobenzamide
Catalog ID
STL532359
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NC(=O)c2ccc(cc2)Cl)NC(=O)C)cc(c1OC)OC
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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 C28H27ClN2O6 MW 522.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27ClN2O6/c1-15(32)30-21-11-7-17-13-24(35-2)26(36-3)27(37-4)25(17)19-10-12-22(23(33)14-20(19)21)31-28(34)16-5-8-18(29)9-6-16/h5-6,8-10,12-14,21H,7,11H2,1-4H3,(H,30,32)(H,31,33,34)/t21-/m0/s1InChIKey
PNXIWYSSBIOTTI-NRFANRHFSA-NSynonyms
220191-29-7(S)N(7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)4chlorobenzamide
~(N)((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)4chlorobenzamide
16406337
220191297
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NC(=O)c2ccc(cc2)Cl)NC(=O)C)cc(c1OC)OC
InChI=1SC28H27ClN2O6c115(32)3021117171324(352)26(363)27(374)25(17)19101222(23(33)1420(19)21)3128(34)165818(29)9616h56810121421H711H214H3(H3032)(H313334)t21m0s1
MFCD08002491
N((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)4chlorobenzamide
ZINC000008876444
ZINC8876444
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