Vitas-M small molecule compound
2-(3,3,6,6,10-pentamethyl-1,8-dioxo-1,2,3,4,5,6,7,8,9,10-decahydroacridin-9-yl)phenyl 4-methylbenzenesulfonate
Catalog ID
STL375070
SMILES Cc1ccc(cc1)S(=O)(=O)Oc1ccccc1C1C2=C(CC(CC2=O)(C)C)N(C2=C1C(=O)CC(C2)(C)C)C
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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 C31H35NO5S MW 533.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H35NO5S/c1-19-11-13-20(14-12-19)38(35,36)37-26-10-8-7-9-21(26)27-28-22(15-30(2,3)17-24(28)33)32(6)23-16-31(4,5)18-25(34)29(23)27/h7-14,27H,15-18H2,1-6H3InChIKey
VNQZRLXVNVLLBT-UHFFFAOYSA-NSynonyms
(2(336610pentamethyl18dioxo4579tetrahydro2Hacridin9yl)phenyl)4methylbenzenesulfonate
2(336610pentamethyl18dioxo12345678910decahydroacridin9yl)phenyl4methylbenzenesulfonate
CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2C3C4=C(CC(CC4=O)(C)C)N(C5=C3C(=O)CC(C5)(C)C)C
InChI=1SC31H35NO5Sc119111320(141219)38(3536)37261087921(26)272822(1530(23)1724(28)33)32(6)231631(45)1825(34)29(23)27h71427H1518H216H3
MFCD03271862
ZINC000002168811
ZINC02168811
ZINC2168811
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