Vitas-M small molecule compound
(8S,8aR,11aS)-8-(1,3-benzodioxol-5-ylcarbonyl)-10-(2,3-dihydro-1,4-benzodioxin-6-yl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STL542262
SMILES O=C([C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2C2N1C=Cc1c2cccc1)c1ccc2c(c1)OCCO2)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 C30H22N2O7 MW 522.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H22N2O7/c33-28(17-5-7-21-22(13-17)39-15-38-21)27-25-24(26-19-4-2-1-3-16(19)9-10-31(26)27)29(34)32(30(25)35)18-6-8-20-23(14-18)37-12-11-36-20/h1-10,13-14,24-27H,11-12,15H2/t24-,25+,26?,27-/m0/s1InChIKey
KLMGHKMBQIGELN-UEEAVMEZSA-NSynonyms
956196-74-0(11~(S)12~(R)16~(S))11(13benzodioxole5carbonyl)14(23dihydro14benzodioxin6yl)1014diazatetracyclo(8600^(27)0^(1216))hexadeca2468tetraene1315dione
(8S8aR11aS)8(13benzodioxol5ylcarbonyl)10(23dihydro14benzodioxin6yl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
(8S8aR11aS)8(benzo(d)(13)dioxole5carbonyl)10(23dihydrobenzo(b)(14)dioxin6yl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
16399919
956196740
InChI=1SC30H22N2O7c3328(17572122(1317)39153821)272524(2619421316(19)91031(26)27)29(34)32(30(25)35)18682023(1418)3712113620h11013142427H111215H2t2425+26?27m0s1
MFCD04146482
O=C((C@@H)1(C@@H)2C(=O)N(C(=O)(C@@H)2C2N1C=Cc1c2cccc1)c1ccc2c(c1)OCCO2)c1ccc2c(c1)OCO2
ZINC000070686901
ZINC000070686906
Check stock
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Check stock on Vitas-MAvailable files
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