Vitas-M small molecule compound
2',4,5',6-tetra-tert-butyl-3'-hydroxy-4'H-spiro[1,3-benzodioxole-2,1'-cyclohexa[2,5]dien]-4'-one
Catalog ID
STK525204
SMILES O=C1C(=C(C(C)(C)C)C2(C=C1C(C)(C)C)Oc1c(O2)cc(cc1C(C)(C)C)C(C)(C)C)O
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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 C28H40O4 MW 440.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H40O4/c1-24(2,3)16-13-17(25(4,5)6)22-19(14-16)31-28(32-22)15-18(26(7,8)9)20(29)21(30)23(28)27(10,11)12/h13-15,30H,1-12H3InChIKey
DCQDNCVZSDHESB-UHFFFAOYSA-NSynonyms
115214-74-9115214749
2456tetratertbutyl3hydroxy4Hspiro(13benzodioxole21cyclohexa(25)dien)4one
2456tetratertbutyl3hydroxyspiro(benzo(d)(13)dioxole21cyclohexa(25)dien)4one
3466tetratertbutyl2hydroxyspiro(13benzodioxole24cyclohexa25diene)1one
CC(C)(C)C1=CC(=C2C(=C1)OC3(O2)C=C(C(=O)C(=C3C(C)(C)C)O)C(C)(C)C)C(C)(C)C
InChI=1SC28H40O4c124(23)161317(25(45)6)2219(1416)3128(3222)1518(26(78)9)20(29)21(30)23(28)27(1011)12h131530H112H3
MFCD00331804
ZINC000013510938
ZINC000013510941
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