Vitas-M small molecule compound

4-[5-(hydroxymethyl)-6,8,9-trimethyl-3-oxabicyclo[3.3.1]non-7-en-2-yl]phenol

Catalog ID
STK099432
SMILES OCC12COC(C(C2C)C(=CC1C)C)c1ccc(cc1)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 C18H24O3 MW 288.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24O3/c1-11-8-12(2)18(9-19)10-21-17(16(11)13(18)3)14-4-6-15(20)7-5-14/h4-8,12-13,16-17,19-20H,9-10H2,1-3H3
InChIKey
DTZWKYVREFMAJA-UHFFFAOYSA-N
Synonyms

4((1R5R9R)5(hydroxymethyl)689trimethyl3oxabicyclo(331)non7en2yl)phenol
4(5(HYDROXYMETHYL)249TRIMETHYL7OXABICYCLO(331)NON2EN8YL)PHENOL
4(5(HYDROXYMETHYL)689TRIMETHYL3OXABICYCLO(331)NON7EN2YL)PHENOL
CC1C=C(C2C(C1(COC2C3=CC=C(C=C3)O)CO)C)C
InChI=1SC18H24O3c111812(2)18(919)102117(16(11)13(18)3)144615(20)7514h48121316171920H910H213H3
MFCD01080736
OC(C@@)12COC((C@H)(C2C)C(=CC1C)C)c1ccc(cc1)O
OCC12COC(C(C2C)C(=CC1C)C)c1ccc(cc1)O
STK099432
ZINC000100643042
ZINC000248329882

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Available files

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