Vitas-M small molecule compound
2-{5-[(acetyloxy)methyl]-6,8,9-trimethyl-3-oxabicyclo[3.3.1]non-7-en-2-yl}phenyl acetate
Catalog ID
STK003482
SMILES CC(=O)OCC12COC(C(C2C)C(=CC1C)C)c1ccccc1OC(=O)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 C22H28O5 MW 372.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28O5/c1-13-10-14(2)22(11-25-16(4)23)12-26-21(20(13)15(22)3)18-8-6-7-9-19(18)27-17(5)24/h6-10,14-15,20-21H,11-12H2,1-5H3InChIKey
ZWLSDBYOOPGGSP-UHFFFAOYSA-NSynonyms
376351-74-5(8(2ACETYLOXYPHENYL)249TRIMETHYL7OXABICYCLO(331)NON2EN5YL)METHYLACETATE
2((1S2S5R6R9S)5(acetoxymethyl)689trimethyl3oxabicyclo(331)non7en2yl)phenylacetate
2(5((ACETYLOXY)METHYL)689TRIMETHYL3OXABICYCLO(331)NON7EN2YL)PHENYLACETATE
376351745
CC(=O)OCC12COC(C((C@@H)2C)C(=CC1C)C)c1ccccc1OC(=O)C
CC(=O)OCC12COC(C(C2C)C(=CC1C)C)c1ccccc1OC(=O)C
CC1C=C(C2C(C1(COC2C3=CC=CC=C3OC(=O)C)COC(=O)C)C)C
InChI=1SC22H28O5c1131014(2)22(112516(4)23)122621(20(13)15(22)3)18867919(18)2717(5)24h61014152021H1112H215H3
MFCD01308516
STK003482
ZINC000000843957
ZINC000043736073
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