Vitas-M small molecule compound
(1'R,2'R)-1'-(2,2-dimethylpropanoyl)-2'-(3-methoxyphenyl)-7'-methyl-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Catalog ID
STK599479
SMILES COc1cccc(c1)[C@H]1[C@@H](N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)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 C33H31NO4 MW 505.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H31NO4/c1-19-13-15-25-20(17-19)14-16-26-33(29(35)23-11-6-7-12-24(23)30(33)36)27(21-9-8-10-22(18-21)38-5)28(34(25)26)31(37)32(2,3)4/h6-18,26-28H,1-5H3/t26?,27-,28+/m0/s1InChIKey
BJOMFQBDYSXPQA-GUQXXGRISA-NSynonyms
1216944-85-2(1R2R)1(22dimethylpropanoyl)2(3methoxyphenyl)7methyl12dihydro3aHspiro(indene23pyrrolo(12a)quinoline)13dione
(1R2R)1(22dimethylpropanoyl)2(3methoxyphenyl)7methylspiro(23adihydro1Hpyrrolo(12a)quinoline32indene)13dione
(1R2R)2(3methoxyphenyl)7methyl1pivaloyl23adihydro1Hspiro(indene23pyrrolo(12a)quinoline)13dione
1216944852
CC1=CC2=C(C=C1)N3C(C=C2)C4(C(C3C(=O)C(C)(C)C)C5=CC(=CC=C5)OC)C(=O)C6=CC=CC=C6C4=O
COc1cccc(c1)(C@H)1(C@@H)(N2C((C@@)31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)C)C(=O)C(C)(C)C
COc1cccc(c1)(C@H)1(C@@H)(N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)C)C(=O)C(C)(C)C
InChI=1SC33H31NO4c11913152520(1719)14162633(29(35)2311671224(23)30(33)36)27(21981022(1821)385)28(34(25)26)31(37)32(23)4h6182628H15H3t26?2728+m0s1
ZINC000009293736
ZINC000009293737
Check stock
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Check stock on Vitas-MAvailable files
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