Vitas-M small molecule compound
(1'S,2'S,3R,3a'R)-1'-acetyl-2'-(1,3-benzodioxol-5-ylcarbonyl)-7'-methyl-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Catalog ID
STL532856
SMILES Cc1ccc2c(c1)C=C[C@H]1N2[C@H](C(=O)C)[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccc2c(c1)OCO2
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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 C30H24N2O5 MW 492.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H24N2O5/c1-16-7-10-22-18(13-16)9-12-25-30(20-5-3-4-6-21(20)31-29(30)35)26(27(17(2)33)32(22)25)28(34)19-8-11-23-24(14-19)37-15-36-23/h3-14,25-27H,15H2,1-2H3,(H,31,35)/t25-,26+,27-,30-/m1/s1InChIKey
HHIVHNAPXWJKBO-UUROJUAVSA-NSynonyms
1177842-64-6(1~(S)2~(S)3~(R)3~(a)~(R))1acetyl2(13benzodioxole5carbonyl)7methylspiro(1~(H)indole3323~(a)dihydro1~(H)pyrrolo(12a)quinoline)2one
(1S2S3R3aR)1acetyl2(13benzodioxol5ylcarbonyl)7methyl12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
(1S2S3R3aR)1acetyl2(benzo(d)(13)dioxole5carbonyl)7methyl23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
1177842646
16399960
Cc1ccc2c(c1)C=C(C@H)1N2(C@H)(C(=O)C)(C@H)((C@@)21C(=O)Nc1c2cccc1)C(=O)c1ccc2c(c1)OCO2
InChI=1SC30H24N2O5c1167102218(1316)9122530(20534621(20)3129(30)35)26(27(17(2)33)32(22)25)28(34)198112324(1419)37153623h3142527H15H212H3(H3135)t2526+2730m1s1
MFCD04146714
ZINC000008917978
ZINC8917978
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.