Vitas-M small molecule compound
3-{9-[3-iodo-5-methoxy-4-(naphthalen-1-ylmethoxy)phenyl]-3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydroacridin-10(1H)-yl}propanoic acid
Catalog ID
STK044837
SMILES COc1cc(cc(c1OCc1cccc2c1cccc2)I)C1C2=C(CC(CC2=O)(C)C)N(C2=C1C(=O)CC(C2)(C)C)CCC(=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 C38H40INO6 MW 733.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H40INO6/c1-37(2)17-27-34(29(41)19-37)33(35-28(40(27)14-13-32(43)44)18-38(3,4)20-30(35)42)24-15-26(39)36(31(16-24)45-5)46-21-23-11-8-10-22-9-6-7-12-25(22)23/h6-12,15-16,33H,13-14,17-21H2,1-5H3,(H,43,44)InChIKey
GJJNVLVJTCOKJH-UHFFFAOYSA-NSynonyms
3(9(3iodo5methoxy4(naphthalen1ylmethoxy)phenyl)3366tetramethyl18dioxo23456789octahydroacridin10(1H)yl)propanoicacid
3(9(3iodo5methoxy4(naphthalen1ylmethoxy)phenyl)3366tetramethyl18dioxo4579tetrahydro2Hacridin10yl)propanoicacid
CC1(CC2=C(C(C3=C(N2CCC(=O)O)CC(CC3=O)(C)C)C4=CC(=C(C(=C4)I)OCC5=CC=CC6=CC=CC=C65)OC)C(=O)C1)C
COc1cc(cc(c1OCc1cccc2c1cccc2)I)C1C2=C(CC(CC2=O)(C)C)N(C2=C1C(=O)CC(C2)(C)C)CCC(=O)O
InChI=1SC38H40INO6c137(2)172734(29(41)1937)33(3528(40(27)141332(43)44)1838(34)2030(35)42)241526(39)36(31(1624)455)46212311810229671225(22)23h612151633H13141721H215H3(H4344)
MFCD03725748
STK044837
ZINC000097995603
ZINC97995603
Check stock
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