Vitas-M small molecule compound
methyl 2-[10-(2,2-dimethylpropanoyl)-3,5-dimethyl-7,9-dioxo-6b,7,9a,10-tetrahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinolin-8(9H)-yl]benzoate
Catalog ID
STL237952
SMILES COC(=O)c1ccccc1N1C(=O)C2C(C1=O)C(N1C2C=C(C)c2c1ccc(c2)C)C(=O)C(C)(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 C29H30N2O5 MW 486.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O5/c1-15-11-12-20-18(13-15)16(2)14-21-22-23(24(30(20)21)25(32)29(3,4)5)27(34)31(26(22)33)19-10-8-7-9-17(19)28(35)36-6/h7-14,21-24H,1-6H3InChIKey
MUCKZIZNUJMHAC-UHFFFAOYSA-NSynonyms
CC1=CC2=C(C=C1)N3C(C=C2C)C4C(C3C(=O)C(C)(C)C)C(=O)N(C4=O)C5=CC=CC=C5C(=O)OC
COC(=O)c1ccccc1N1C(=O)(C@@H)2(C@H)(C1=O)(C@@H)(N1C2C=C(C)c2c1ccc(c2)C)C(=O)C(C)(C)C
InChI=1SC29H30N2O5c11511122018(1315)16(2)14212223(24(30(20)21)25(32)29(34)5)27(34)31(26(22)33)191087917(19)28(35)366h7142124H16H3
methyl2((6bR9aS10R)35dimethyl79dioxo10pivaloyl6b79a10tetrahydro6aHpyrrolo(3434)pyrrolo(12a)quinolin8(9H)yl)benzoate
methyl2(10(22dimethylpropanoyl)35dimethyl79dioxo6b79a10tetrahydro6aHpyrrolo(3434)pyrrolo(12a)quinolin8(9H)yl)benzoate
MFCD07202371
ZINC000017749866
ZINC000253389822
Check stock
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Check stock on Vitas-MAvailable files
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