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-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)hexanamide
Catalog ID
STL549507
SMILES COc1c(OC)cc2c(c1OC)c1ccc(c(=O)cc1[C@H](CC2)NC(=O)C)NCCCCCC(=O)NC1CCCc2c1[nH]c1c2cccc1
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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 C39H46N4O6 MW 666.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H46N4O6/c1-23(44)41-30-18-16-24-21-34(47-2)38(48-3)39(49-4)36(24)26-17-19-31(33(45)22-28(26)30)40-20-9-5-6-15-35(46)42-32-14-10-12-27-25-11-7-8-13-29(25)43-37(27)32/h7-8,11,13,17,19,21-22,30,32,43H,5-6,9-10,12,14-16,18,20H2,1-4H3,(H,40,45)(H,4InChIKey
VXLIPEBDFCWRSF-TZYYSAMKSA-NSynonyms
129895448
6(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(2349tetrahydro1~(H)carbazol1yl)hexanamide
6(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(2349tetrahydro1Hcarbazol1yl)hexanamide
6(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(2349tetrahydro1Hcarbazol1yl)hexanamide
COc1c(OC)cc2c(c1OC)c1ccc(c(=O)cc1(C@H)(CC2)NC(=O)C)NCCCCCC(=O)NC1CCCc2c1(nH)c1c2cccc1
InChI=1SC39H46N4O6c123(44)41301816242134(472)38(483)39(494)36(24)26171931(33(45)2228(26)30)40209561535(46)4232141012272511781329(25)4337(27)32h78111317192122303243H569101214161820H214H3(H4045)(H4144)(H4246)t3032?m0s1
ZINC000524731395
ZINC000524731396
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.