Vitas-M small molecule compound

1-(2,3,5,6,8,9-hexahydro-1,4,7,10-benzotetraoxacyclododecin-12-yl)-2,2-diphenylethanone

Catalog ID
STK525360
SMILES O=C(C(c1ccccc1)c1ccccc1)c1ccc2c(c1)OCCOCCOCCO2

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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 C26H26O5 MW 418.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26O5/c27-26(25(20-7-3-1-4-8-20)21-9-5-2-6-10-21)22-11-12-23-24(19-22)31-18-16-29-14-13-28-15-17-30-23/h1-12,19,25H,13-18H2
InChIKey
HHIXYYPBADOWQT-UHFFFAOYSA-N
Synonyms
126079-95-6
1(235689hexahydro14710benzotetraoxacyclododecin12yl)22diphenylethanone
1(235689hexahydrobenzo(b)(14710)tetraoxacyclododecin12yl)22diphenylethanone
126079956
22diphenyl1(25811tetraoxabicyclo(1040)hexadeca1(12)1315trien14yl)ethanone
C1COCCOC2=C(C=CC(=C2)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)OCCO1
InChI=1SC26H26O5c2726(25(207314820)2195261021)2211122324(1922)3118162914132815173023h1121925H1318H2
MFCD01089675
ZINC000002268482
ZINC02268482
ZINC2268482

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Available files

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