Vitas-M small molecule compound
N-{(7S)-10-[(2-ethoxyphenyl)amino]-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl}acetamide
Catalog ID
STL531493
SMILES CCOc1ccccc1Nc1ccc2c(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 C29H32N2O6 MW 504.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N2O6/c1-6-37-25-10-8-7-9-23(25)31-22-14-12-19-20(16-24(22)33)21(30-17(2)32)13-11-18-15-26(34-3)28(35-4)29(36-5)27(18)19/h7-10,12,14-16,21H,6,11,13H2,1-5H3,(H,30,32)(H,31,33)/t21-/m0/s1InChIKey
SITLFYODCLWFKA-NRFANRHFSA-NSynonyms
1212105-06-0(S)N(10((2ethoxyphenyl)amino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen7yl)acetamide
~(N)((7~(S))10(2ethoxyanilino)123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen7yl)acetamide
1212105060
16405344
CCOc1ccccc1Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC29H32N2O6c1637251087923(25)312214121920(1624(22)33)21(3017(2)32)1311181526(343)28(354)29(365)27(18)19h71012141621H61113H215H3(H3032)(H3133)t21m0s1
MFCD06770131
N((7S)10((2ethoxyphenyl)amino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen7yl)acetamide
ZINC000008791583
ZINC8791583
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