Vitas-M small molecule compound

3-[(3-methoxybenzyl)oxy]-8,9,10,11-tetrahydrocyclohepta[c]chromen-6(7H)-one

Catalog ID
STK716576
SMILES COc1cccc(c1)COc1ccc2c(c1)oc(=O)c1c2CCCCC1

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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 C22H22O4 MW 350.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22O4/c1-24-16-7-5-6-15(12-16)14-25-17-10-11-19-18-8-3-2-4-9-20(18)22(23)26-21(19)13-17/h5-7,10-13H,2-4,8-9,14H2,1H3
InChIKey
OLSMODLOHFMPDI-UHFFFAOYSA-N
Synonyms
840497-06-5
3((3methoxybenzyl)oxy)891011tetrahydrocyclohepta(c)chromen6(7H)one
3((3methoxyphenyl)methoxy)891011tetrahydro7Hcyclohepta(c)chromen6one
840497065
COC1=CC=CC(=C1)COC2=CC3=C(C=C2)C4=C(CCCCC4)C(=O)O3
InChI=1SC22H22O4c1241675615(1216)142517101119188324920(18)22(23)2621(19)1317h571013H248914H21H3
MFCD04008305
ZINC000005100531
ZINC05100531
ZINC5100531

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.