Vitas-M small molecule compound
(6aR,6bS,9aR,10S)-8-(2,3-dihydro-1,4-benzodioxin-6-yl)-10-[(3-nitrophenyl)carbonyl]-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Catalog ID
STK542541
SMILES O=C([C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2[C@@H]2N1c1ccccc1C=C2)c1ccc2c(c1)OCCO2)c1cccc(c1)[N+](=O)[O-]
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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 C29H21N3O7 MW 523.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H21N3O7/c33-27(17-5-3-6-19(14-17)32(36)37)26-25-24(21-10-8-16-4-1-2-7-20(16)31(21)26)28(34)30(29(25)35)18-9-11-22-23(15-18)39-13-12-38-22/h1-11,14-15,21,24-26H,12-13H2/t21-,24-,25-,26+/m1/s1InChIKey
VJDFSXIVHQARBH-MYCYEZBNSA-NSynonyms
1013755-86-6(6aR6bS9aR10S)8(23dihydro14benzodioxin6yl)10((3nitrophenyl)carbonyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
(6aR6bS9aR10S)8(23dihydrobenzo(b)(14)dioxin6yl)10(3nitrobenzoyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
1013755866
C1COC2=C(O1)C=CC(=C2)N3C(=O)C4C5C=CC6=CC=CC=C6N5C(C4C3=O)C(=O)C7=CC(=CC=C7)(N+)(=O)(O)
InChI=1SC29H21N3O7c3327(1753619(1417)32(36)37)262524(2110816412720(16)31(21)26)28(34)30(29(25)35)189112223(1518)3913123822h1111415212426H1213H2t21242526+m1s1
MFCD18242005
O=C((C@@H)1(C@@H)2C(=O)N(C(=O)(C@@H)2(C@@H)2N1c1ccccc1C=C2)c1ccc2c(c1)OCCO2)c1cccc(c1)(N+)(=O)(O)
ZINC000100894456
ZINC100894456
Check stock
See real-time availability and sample size for STK542541 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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