Vitas-M small molecule compound
(8S,8aR,11aS)-10-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-[(4-methoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STK548642
SMILES COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=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 C30H24N2O6 MW 508.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H24N2O6/c1-36-20-9-6-18(7-10-20)28(33)27-25-24(26-21-5-3-2-4-17(21)12-13-31(26)27)29(34)32(30(25)35)19-8-11-22-23(16-19)38-15-14-37-22/h2-13,16,24-27H,14-15H2,1H3/t24-,25+,26?,27-/m0/s1InChIKey
XFBFYWUGKLXKAT-UEEAVMEZSA-NSynonyms
956988-96-8(8S8aR11aS)10(23dihydro14benzodioxin6yl)8((4methoxyphenyl)carbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
(8S8aR11aS)10(23dihydrobenzo(b)(14)dioxin6yl)8(4methoxybenzoyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
956988968
COC1=CC=C(C=C1)C(=O)C2C3C(C4N2C=CC5=CC=CC=C45)C(=O)N(C3=O)C6=CC7=C(C=C6)OCCO7
COc1ccc(cc1)C(=O)(C@H)1N2C=Cc3c(C2(C@@H)2(C@H)1C(=O)N(C2=O)c1ccc2c(c1)OCCO2)cccc3
InChI=1SC30H24N2O6c136209618(71020)28(33)272524(2621532417(21)121331(26)27)29(34)32(30(25)35)198112223(1619)3815143722h213162427H1415H21H3t2425+26?27m0s1
MFCD18242428
ZINC000016035198
ZINC000100829750
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.