Vitas-M small molecule compound
ethyl 4-[(8S,8aR,11aS)-8-[(4-nitrophenyl)carbonyl]-9,11-dioxo-8a,9,11a,11b-tetrahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinolin-10(11H)-yl]benzoate
Catalog ID
STL053412
SMILES CCOC(=O)c1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2ccc(cc2)[N+](=O)[O-])C=Cc2c1cccc2
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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 C30H23N3O7 MW 537.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23N3O7/c1-2-40-30(37)19-9-11-20(12-10-19)32-28(35)23-24(29(32)36)26(27(34)18-7-13-21(14-8-18)33(38)39)31-16-15-17-5-3-4-6-22(17)25(23)31/h3-16,23-26H,2H2,1H3/t23-,24+,25?,26-/m0/s1InChIKey
JNQMUKCDYNLRIY-HLMSNRGBSA-NSynonyms
1214626-99-91214626999
CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3C(C2=O)C(N4C3C5=CC=CC=C5C=C4)C(=O)C6=CC=C(C=C6)(N+)(=O)(O)
CCOC(=O)c1ccc(cc1)N1C(=O)(C@@H)2(C@H)(C1=O)C1N((C@@H)2C(=O)c2ccc(cc2)(N+)(=O)(O))C=Cc2c1cccc2
ethyl4((8S8aR11aS)8((4nitrophenyl)carbonyl)911dioxo8a911a11btetrahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinolin10(11H)yl)benzoate
ethyl4((8S8aR11aS)8(4nitrobenzoyl)911dioxo8a91111atetrahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinolin10(11bH)yl)benzoate
InChI=1SC30H23N3O7c124030(37)1991120(121019)3228(35)2324(29(32)36)26(27(34)1871321(14818)33(38)39)31161517534622(17)25(23)31h3162326H2H21H3t2324+25?26m0s1
MFCD18249534
ZINC000101231546
ZINC000101231549
Check stock
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Check stock on Vitas-MAvailable files
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