Vitas-M small molecule compound
(8S,8aR,11aS)-10-(1,3-benzodioxol-5-ylmethyl)-8-(phenylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STL532820
SMILES O=C([C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2C2N1C=Cc1c2cccc1)Cc1ccc2c(c1)OCO2)c1ccccc1
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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 C29H22N2O5 MW 478.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22N2O5/c32-27(19-7-2-1-3-8-19)26-24-23(25-20-9-5-4-6-18(20)12-13-30(25)26)28(33)31(29(24)34)15-17-10-11-21-22(14-17)36-16-35-21/h1-14,23-26H,15-16H2/t23-,24+,25?,26-/m0/s1InChIKey
AHPHQJCTZGBEMP-HLMSNRGBSA-NSynonyms
957043-72-0(11~(S)12~(R)16~(S))14(13benzodioxol5ylmethyl)11benzoyl1014diazatetracyclo(8600^(27)0^(1216))hexadeca2468tetraene1315dione
(8S8aR11aS)10(13benzodioxol5ylmethyl)8(phenylcarbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
(8S8aR11aS)10(benzo(d)(13)dioxol5ylmethyl)8benzoyl11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
16399195
957043720
InChI=1SC29H22N2O5c3227(197213819)262423(2520954618(20)121330(25)26)28(33)31(29(24)34)151710112122(1417)36163521h1142326H1516H2t2324+25?26m0s1
MFCD04142222
O=C((C@@H)1(C@@H)2C(=O)N(C(=O)(C@@H)2C2N1C=Cc1c2cccc1)Cc1ccc2c(c1)OCO2)c1ccccc1
ZINC000016042940
ZINC000043741292
Check stock
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Check stock on Vitas-MAvailable files
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