Vitas-M small molecule compound

3-[(4-methoxybenzyl)oxy]-8,9,10,11-tetrahydrocyclohepta[c]chromen-6(7H)-one

Catalog ID
STK716578
SMILES COc1ccc(cc1)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/c1-24-16-9-7-15(8-10-16)14-25-17-11-12-19-18-5-3-2-4-6-20(18)22(23)26-21(19)13-17/h7-13H,2-6,14H2,1H3
InChIKey
HKMRHMYVKZZXOU-UHFFFAOYSA-N
Synonyms
670245-40-6
3((4methoxybenzyl)oxy)891011tetrahydrocyclohepta(c)chromen6(7H)one
3((4methoxyphenyl)methoxy)891011tetrahydro7Hcyclohepta(c)chromen6one
670245406
COC1=CC=C(C=C1)COC2=CC3=C(C=C2)C4=C(CCCCC4)C(=O)O3
InChI=1SC22H22O4c124169715(81016)142517111219185324620(18)22(23)2621(19)1317h713H2614H21H3
MFCD04004470
ZINC000002258312
ZINC02258312
ZINC2258312

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Available files

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