Vitas-M small molecule compound

1-O-[(2-hydroxyphenyl)carbonyl]hexitol

Catalog ID
STL549029
SMILES OCC(C(C(C(COC(=O)c1ccccc1O)O)O)O)O

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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 C13H18O8 MW 302.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18O8/c14-5-9(16)11(18)12(19)10(17)6-21-13(20)7-3-1-2-4-8(7)15/h1-4,9-12,14-19H,5-6H2
InChIKey
DTKRGJZNRMIPRF-UHFFFAOYSA-N
Synonyms
1174156-02-5
1174156025
1O((2hydroxyphenyl)carbonyl)hexitol
23456pentahydroxyhexyl2hydroxybenzoate
3778687
InChI=1SC13H18O8c1459(16)11(18)12(19)10(17)62113(20)731248(7)15h149121419H56H2
MFCD01084012
ZINC000004064300
ZINC000012861143
ZINC02104398

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Available files

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