Vitas-M small molecule compound
4-(9,10-dimethoxy-5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)-N-{2-[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]ethyl}butanamide
Catalog ID
STL579057
SMILES COc1ccc2c(c1OC)C(=O)N1C2N(CCCC(=O)NCCN2C[C@H]3C[C@@H](C2)c2n(C3)c(=O)ccc2)C(=O)c2c1cccc2
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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 C34H37N5O6 MW 611.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H37N5O6/c1-44-27-13-12-24-30(31(27)45-2)34(43)39-26-8-4-3-7-23(26)33(42)37(32(24)39)15-6-10-28(40)35-14-16-36-18-21-17-22(20-36)25-9-5-11-29(41)38(25)19-21/h3-5,7-9,11-13,21-22,32H,6,10,14-20H2,1-2H3,(H,35,40)/t21-,22+,32?/m1/s1InChIKey
NCVOYIGNLDGRLL-LNOHLJFZSA-NSynonyms
4(910dimethoxy511dioxo6a11dihydroisoindolo(21a)quinazolin6(5H)yl)N(2((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)ethyl)butanamide
4(910dimethoxy511dioxoisoindolo(21a)quinazolin6(5H6aH11H)yl)N(2((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)ethyl)butanamide
COc1ccc2c(c1OC)C(=O)N1C2N(CCCC(=O)NCCN2C(C@H)3C(C@@H)(C2)c2n(C3)c(=O)ccc2)C(=O)c2c1cccc2
InChI=1SC34H37N5O6c1442713122430(31(27)452)34(43)3926843723(26)33(42)37(32(24)39)1561028(40)3514163618211722(2036)25951129(41)38(25)1921h35791113212232H6101420H212H3(H3540)t2122+32?m1s1
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.