Vitas-M small molecule compound
9-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Catalog ID
STK741606
SMILES OC1=C(C(=O)CC(C1)(C)C)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 C25H32O5 MW 412.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32O5/c1-23(2)7-13(26)19(14(27)8-23)22-20-15(28)9-24(3,4)11-17(20)30-18-12-25(5,6)10-16(29)21(18)22/h22,26H,7-12H2,1-6H3InChIKey
MNSNMKQVZCREDU-UHFFFAOYSA-NSynonyms
33742-88-033742880
9(2hydroxy44dimethyl6oxocyclohex1en1yl)3366tetramethyl345679hexahydro1Hxanthene18(2H)dione
9(2hydroxy44dimethyl6oxocyclohexen1yl)3366tetramethyl4579tetrahydro2Hxanthene18dione
CC1(CC(=C(C(=O)C1)C2C3=C(CC(CC3=O)(C)C)OC4=C2C(=O)CC(C4)(C)C)O)C
InChI=1SC25H32O5c123(2)713(26)19(14(27)823)222015(28)924(34)1117(20)30181225(56)1016(29)21(18)22h2226H712H216H3
MFCD01412861
ZINC000000980068
ZINC980068
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