Vitas-M small molecule compound
9-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Catalog ID
STK836092
SMILES COc1ccc(cc1CN1CCOCC1)C1C2=C(OC3=C1C(=O)CC(C3)(C)C)CC(CC2=O)(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 C29H37NO5 MW 479.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H37NO5/c1-28(2)13-20(31)26-23(15-28)35-24-16-29(3,4)14-21(32)27(24)25(26)18-6-7-22(33-5)19(12-18)17-30-8-10-34-11-9-30/h6-7,12,25H,8-11,13-17H2,1-5H3InChIKey
RLQDFMHJOKBHCV-UHFFFAOYSA-NSynonyms
9(4methoxy3(morpholin4ylmethyl)phenyl)3366tetramethyl345679hexahydro1Hxanthene18(2H)dione
9(4methoxy3(morpholin4ylmethyl)phenyl)3366tetramethyl4579tetrahydro2Hxanthene18dione
9(4methoxy3(morpholinomethyl)phenyl)3366tetramethyl345679hexahydro1Hxanthene18(2H)dione
CC1(CC2=C(C(C3=C(O2)CC(CC3=O)(C)C)C4=CC(=C(C=C4)OC)CN5CCOCC5)C(=O)C1)C
InChI=1SC29H37NO5c128(2)1320(31)2623(1528)35241629(34)1421(32)27(24)25(26)186722(335)19(1218)17308103411930h671225H8111317H215H3
MFCD02734101
ZINC000013424300
ZINC13424300
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