Vitas-M small molecule compound

3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxo-6-propyl-4H-chromen-7-yl morpholine-4-carboxylate

Catalog ID
STL228534
SMILES CCCc1cc2c(cc1OC(=O)N1CCOCC1)occ(c2=O)c1ccc2c(c1)OCCCO2

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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 C26H27NO7 MW 465.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27NO7/c1-2-4-18-13-19-23(15-22(18)34-26(29)27-7-11-30-12-8-27)33-16-20(25(19)28)17-5-6-21-24(14-17)32-10-3-9-31-21/h5-6,13-16H,2-4,7-12H2,1H3
InChIKey
SNSQZDUIHIQUFT-UHFFFAOYSA-N
Synonyms
637746-92-0
(3(34DIHYDRO2H15BENZODIOXEPIN7YL)4OXO6PROPYLCHROMEN7YL)MORPHOLINE4CARBOXYLATE
3(34DIHYDRO2H15BENZODIOXEPIN7YL)4OXO6PROPYL4HCHROMEN7YL4MORPHOLINECARBOXYLATE
3(34DIHYDRO2H15BENZODIOXEPIN7YL)4OXO6PROPYL4HCHROMEN7YLMORPHOLINE4CARBOXYLATE
3(34DIHYDRO2HBENZO(B)(14)DIOXEPIN7YL)4OXO6PROPYL4HCHROMEN7YLMORPHOLINE4CARBOXYLATE
637746920
CCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCCCO4)OC(=O)N5CCOCC5
InChI=1SC26H27NO7c12418131923(1522(18)3426(29)277113012827)331620(25(19)28)17562124(1417)3210393121h561316H24712H21H3
MFCD03660771
ZINC000000703825
ZINC00703825
ZINC703825

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Available files

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