Vitas-M small molecule compound
10-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-[(3,4-dimethoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STL234937
SMILES COc1ccc(cc1OC)C(=O)C1N2C=Cc3c(C2C2C1C(=O)N(C2=O)c1ccc2c(c1)OCCO2)cccc3
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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 C31H26N2O7 MW 538.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26N2O7/c1-37-21-9-7-18(15-23(21)38-2)29(34)28-26-25(27-20-6-4-3-5-17(20)11-12-32(27)28)30(35)33(31(26)36)19-8-10-22-24(16-19)40-14-13-39-22/h3-12,15-16,25-28H,13-14H2,1-2H3InChIKey
ZPFHMQCJOKYYND-UHFFFAOYSA-NSynonyms
(8S8aR11aS)10(23dihydrobenzo(b)(14)dioxin6yl)8(34dimethoxybenzoyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
10(23dihydro14benzodioxin6yl)8((34dimethoxyphenyl)carbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
COC1=C(C=C(C=C1)C(=O)C2C3C(C4N2C=CC5=CC=CC=C45)C(=O)N(C3=O)C6=CC7=C(C=C6)OCCO7)OC
COc1ccc(cc1OC)C(=O)(C@H)1N2C=Cc3c(C2(C@@H)2(C@H)1C(=O)N(C2=O)c1ccc2c(c1)OCCO2)cccc3
InChI=1SC31H26N2O7c137219718(1523(21)382)29(34)282625(2720643517(20)111232(27)28)30(35)33(31(26)36)198102224(1619)4014133922h31215162528H1314H212H3
MFCD24858487
ZINC000101159546
ZINC000247946096
Check stock
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Check stock on Vitas-MAvailable files
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