Vitas-M small molecule compound
methyl N-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-L-valylglycinate
Catalog ID
STL543470
SMILES COC(=O)CNC(=O)[C@H](C(C)C)Nc1ccc2c(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 C29H37N3O8 MW 555.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H37N3O8/c1-15(2)26(29(36)30-14-24(35)38-5)32-21-11-9-18-19(13-22(21)34)20(31-16(3)33)10-8-17-12-23(37-4)27(39-6)28(40-7)25(17)18/h9,11-13,15,20,26H,8,10,14H2,1-7H3,(H,30,36)(H,31,33)(H,32,34)/t20-,26-/m0/s1InChIKey
WBQDJJNUYKGNCN-FNZWTVRRSA-NSynonyms
110206206
COC(=O)CNC(=O)(C@H)(C(C)C)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC29H37N3O8c115(2)26(29(36)301424(35)385)32211191819(1322(21)34)20(3116(3)33)108171223(374)27(396)28(407)25(17)18h91113152026H81014H217H3(H3036)(H3133)(H3234)t2026m0s1
methyl2(((2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)3methylbutanoyl)amino)acetate
methyl2((S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)3methylbutanamido)acetate
methylN((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)Lvalylglycinate
ZINC000253413952
ZINC253413952
Check stock
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Check stock on Vitas-MAvailable files
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