Vitas-M small molecule compound
9-[4-(heptyloxy)phenyl]-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Catalog ID
STL023784
SMILES CCCCCCCOc1ccc(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 C30H40O4 MW 464.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H40O4/c1-6-7-8-9-10-15-33-21-13-11-20(12-14-21)26-27-22(31)16-29(2,3)18-24(27)34-25-19-30(4,5)17-23(32)28(25)26/h11-14,26H,6-10,15-19H2,1-5H3InChIKey
OBUHVAKQVNRMPX-UHFFFAOYSA-NSynonyms
799776-94-6799776946
9(4(heptyloxy)phenyl)3366tetramethyl345679hexahydro1Hxanthene18(2H)dione
9(4heptoxyphenyl)3366tetramethyl4579tetrahydro2Hxanthene18dione
CCCCCCCOC1=CC=C(C=C1)C2C3=C(CC(CC3=O)(C)C)OC4=C2C(=O)CC(C4)(C)C
InChI=1SC30H40O4c1678910153321131120(121421)262722(31)1629(23)1824(27)34251930(45)1723(32)28(25)26h111426H6101519H215H3
MFCD00592614
ZINC000002209097
ZINC2209097
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