Vitas-M small molecule compound
6-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)hexanamide
Catalog ID
STL550550
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCCCCC(=O)Nc2ccc3c(c2)OCCO3)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 C35H41N3O8 MW 631.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H41N3O8/c1-21(39)37-26-12-9-22-18-31(42-2)34(43-3)35(44-4)33(22)24-11-13-27(28(40)20-25(24)26)36-15-7-5-6-8-32(41)38-23-10-14-29-30(19-23)46-17-16-45-29/h10-11,13-14,18-20,26H,5-9,12,15-17H2,1-4H3,(H,36,40)(H,37,39)(H,38,41)/t26-/m0/s1InChIKey
SIPVGWLBRXMYFY-SANMLTNESA-NSynonyms
(S)6((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(23dihydrobenzo(b)(14)dioxin6yl)hexanamide
125429287
6(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(23dihydro14benzodioxin6yl)hexanamide
6(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(23dihydro14benzodioxin6yl)hexanamide
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCCCCCC(=O)Nc2ccc3c(c2)OCCO3)NC(=O)C)cc(c1OC)OC
InChI=1SC35H41N3O8c121(39)3726129221831(422)34(433)35(444)33(22)24111327(28(40)2025(24)26)3615756832(41)382310142930(1923)4617164529h10111314182026H59121517H214H3(H3640)(H3739)(H3841)t26m0s1
ZINC000524730674
ZINC524730674
Check stock
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Check stock on Vitas-MAvailable files
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