Vitas-M small molecule compound
4-{[(6aS,6bR,9aS,10R)-7,9-dioxo-8-(2-phenylethyl)-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinolin-10-yl]carbonyl}phenyl acetate
Catalog ID
STK556951
SMILES CC(=O)Oc1ccc(cc1)C(=O)[C@H]1[C@H]2C(=O)N(C(=O)[C@H]2[C@H]2N1c1ccccc1C=C2)CCc1ccccc1
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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 C31H26N2O5 MW 506.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26N2O5/c1-19(34)38-23-14-11-22(12-15-23)29(35)28-27-26(25-16-13-21-9-5-6-10-24(21)33(25)28)30(36)32(31(27)37)18-17-20-7-3-2-4-8-20/h2-16,25-28H,17-18H2,1H3/t25-,26-,27-,28+/m0/s1InChIKey
INPYUMODYYMMGD-LAJGZZDBSA-NSynonyms
1013792-73-81013792738
4(((6aS6bR9aS10R)79dioxo8(2phenylethyl)6b7899a10hexahydro6aHpyrrolo(3434)pyrrolo(12a)quinolin10yl)carbonyl)phenylacetate
4((6aS6bR9aS10R)79dioxo8phenethyl6b7899a10hexahydro6aHpyrrolo(3434)pyrrolo(12a)quinoline10carbonyl)phenylacetate
CC(=O)OC1=CC=C(C=C1)C(=O)C2C3C(C4N2C5=CC=CC=C5C=C4)C(=O)N(C3=O)CCC6=CC=CC=C6
CC(=O)Oc1ccc(cc1)C(=O)(C@H)1(C@H)2C(=O)N(C(=O)(C@H)2(C@H)2N1c1ccccc1C=C2)CCc1ccccc1
InChI=1SC31H26N2O5c119(34)3823141122(121523)29(35)282726(251613219561024(21)33(25)28)30(36)32(31(27)37)1817207324820h2162528H1718H21H3t25262728+m0s1
MFCD18242969
ZINC000101063388
ZINC101063388
Check stock
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Check stock on Vitas-MAvailable files
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