Vitas-M small molecule compound
3,4-dimethoxy-6-{2-oxo-2-[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]ethyl}-5H-indeno[1,2-c]isoquinoline-5,11(6H)-dione
Catalog ID
STL550487
SMILES COc1ccc2c(c1OC)c(=O)n(c1c2C(=O)c2c1cccc2)CC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1
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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 C31H27N3O6 MW 537.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27N3O6/c1-39-23-11-10-21-26-28(19-6-3-4-7-20(19)29(26)37)34(31(38)27(21)30(23)40-2)16-25(36)32-13-17-12-18(15-32)22-8-5-9-24(35)33(22)14-17/h3-11,17-18H,12-16H2,1-2H3/t17-,18+/m1/s1InChIKey
GRVSTZPSDGQVNX-MSOLQXFVSA-NSynonyms
127252820
34dimethoxy6(2oxo2((1~(S)9~(R))6oxo711diazatricyclo(7310^(27))trideca24dien11yl)ethyl)indeno(12c)isoquinoline511dione
34dimethoxy6(2oxo2((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)ethyl)5Hindeno(12c)isoquinoline511(6H)dione
34dimethoxy6(2oxo2((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)ethyl)5Hindeno(12c)isoquinoline511(6H)dione
COc1ccc2c(c1OC)c(=O)n(c1c2C(=O)c2c1cccc2)CC(=O)N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1
InChI=1SC31H27N3O6c139231110212628(19634720(19)29(26)37)34(31(38)27(21)30(23)402)1625(36)3213171218(1532)2285924(35)33(22)1417h3111718H1216H212H3t1718+m1s1
ZINC000604404424
ZINC604404424
Check stock
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Check stock on Vitas-MAvailable files
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