Vitas-M small molecule compound
(1'S,2'R,3R,3a'S)-1'-acetyl-2'-[(3,4-dimethoxyphenyl)carbonyl]-7'-methoxy-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Catalog ID
STL527190
SMILES COc1ccc2c(c1)C=C[C@@H]1N2[C@H](C(=O)C)[C@@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccc(c(c1)OC)OC
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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 C31H28N2O6 MW 524.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28N2O6/c1-17(34)28-27(29(35)19-9-13-24(38-3)25(16-19)39-4)31(21-7-5-6-8-22(21)32-30(31)36)26-14-10-18-15-20(37-2)11-12-23(18)33(26)28/h5-16,26-28H,1-4H3,(H,32,36)/t26-,27+,28+,31+/m0/s1InChIKey
ZOBFHNYEIRCFPU-NLOYNPKYSA-NSynonyms
1177747-57-7(1~(S)2~(R)3~(R)3~(a)~(S))1acetyl2(34dimethoxybenzoyl)7methoxyspiro(1~(H)indole3323~(a)dihydro1~(H)pyrrolo(12a)quinoline)2one
(1S2R3R3aS)1acetyl2((34dimethoxyphenyl)carbonyl)7methoxy12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
(1S2R3R3aS)1acetyl2(34dimethoxybenzoyl)7methoxy23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
1177747577
16397683
COc1ccc2c(c1)C=C(C@@H)1N2(C@H)(C(=O)C)(C@@H)((C@@)21C(=O)Nc1c2cccc1)C(=O)c1ccc(c(c1)OC)OC
InChI=1SC31H28N2O6c117(34)2827(29(35)1991324(383)25(1619)394)31(21756822(21)3230(31)36)261410181520(372)111223(18)33(26)28h5162628H14H3(H3236)t2627+28+31+m0s1
MFCD03266734
ZINC000070672417
ZINC70672417
Check stock
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Check stock on Vitas-MAvailable files
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