Vitas-M small molecule compound

9-(4-hydroxyphenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione

Catalog ID
STK791832
SMILES Oc1ccc(cc1)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 C23H26O4 MW 366.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26O4/c1-22(2)9-15(25)20-17(11-22)27-18-12-23(3,4)10-16(26)21(18)19(20)13-5-7-14(24)8-6-13/h5-8,19,24H,9-12H2,1-4H3
InChIKey
YQVVTBQTVHNTKU-UHFFFAOYSA-N
Synonyms
37797-12-9
37797129
9(4hydroxyphenyl)3366tetramethyl345679hexahydro1Hxanthene18(2H)dione
9(4hydroxyphenyl)3366tetramethyl4579tetrahydro2Hxanthene18dione
CC1(CC2=C(C(C3=C(O2)CC(CC3=O)(C)C)C4=CC=C(C=C4)O)C(=O)C1)C
InChI=1SC23H26O4c122(2)915(25)2017(1122)27181223(34)1016(26)21(18)19(20)135714(24)8613h581924H912H214H3
MFCD00358336
ZINC000000675375
ZINC00675375
ZINC675375

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.