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-(3,4-dimethoxybenzyl)-L-alaninamide
Catalog ID
STL541281
SMILES COc1ccc(cc1OC)CNC(=O)[C@@H](Nc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)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 C33H39N3O8 MW 605.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H39N3O8/c1-18(33(39)34-17-20-8-13-27(40-3)28(14-20)41-4)35-25-12-10-22-23(16-26(25)38)24(36-19(2)37)11-9-21-15-29(42-5)31(43-6)32(44-7)30(21)22/h8,10,12-16,18,24H,9,11,17H2,1-7H3,(H,34,39)(H,35,38)(H,36,37)/t18-,24-/m0/s1InChIKey
BTJKBYNFKROEEG-UUOWRZLLSA-NSynonyms
1574293-71-2(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)((34dimethoxyphenyl)methyl)propanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(34dimethoxybenzyl)propanamide
1574293712
75492550
COc1ccc(cc1OC)CNC(=O)(C@@H)(Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)C
InChI=1SC33H39N3O8c118(33(39)34172081327(403)28(1420)414)352512102223(1626(25)38)24(3619(2)37)119211529(425)31(436)32(447)30(21)22h81012161824H91117H217H3(H3439)(H3538)(H3637)t1824m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(34dimethoxybenzyl)Lalaninamide
ZINC000108451467
ZINC108451467
Check stock
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Check stock on Vitas-MAvailable files
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