Vitas-M small molecule compound
4-(1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)-2-ethoxyphenyl 4-tert-butylbenzoate
Catalog ID
STL023793
SMILES CCOc1cc(ccc1OC(=O)c1ccc(cc1)C(C)(C)C)C1C2=C(CCCC2=O)OC2=C1C(=O)CCC2
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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 C32H34O6 MW 514.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H34O6/c1-5-36-27-18-20(14-17-24(27)38-31(35)19-12-15-21(16-13-19)32(2,3)4)28-29-22(33)8-6-10-25(29)37-26-11-7-9-23(34)30(26)28/h12-18,28H,5-11H2,1-4H3InChIKey
XPBBZNQUAROTBB-UHFFFAOYSA-NSynonyms
836626-38-1(4(18dioxo345679hexahydro2Hxanthen9yl)2ethoxyphenyl)4tertbutylbenzoate
4(18dioxo23456789octahydro1Hxanthen9yl)2ethoxyphenyl4(tertbutyl)benzoate
4(18dioxo23456789octahydro1Hxanthen9yl)2ethoxyphenyl4tertbutylbenzoate
CCOC1=C(C=CC(=C1)C2C3=C(CCCC3=O)OC4=C2C(=O)CCC4)OC(=O)C5=CC=C(C=C5)C(C)(C)C
Registry IDs
MFCD03688271ZINC000009461538
ZINC09461538
ZINC9461538
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