200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 10019-60-0
10019-60-0 | Benzoic acid, 2-(β-D-glucopyranosyloxy)-, methyl ester
CAS No: 10019-60-0 Catalog No: AG000173 MDL No:
Product Description
Catalog Number:
AG000173
Chemical Name:
Benzoic acid, 2-(β-D-glucopyranosyloxy)-, methyl ester
CAS Number:
10019-60-0
Molecular Formula:
C14H18O8
Molecular Weight:
314.2879
IUPAC Name:
methyl 2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzoate
InChI:
InChI=1S/C14H18O8/c1-20-13(19)7-4-2-3-5-8(7)21-14-12(18)11(17)10(16)9(6-15)22-14/h2-5,9-12,14-18H,6H2,1H3/t9-,10-,11+,12-,14-/m1/s1
InChI Key:
ONKIQNFPVXNOBV-YGEZULPYSA-N
SMILES:
OC[C@H]1O[C@@H](Oc2ccccc2C(=O)OC)[C@@H]([C@H]([C@@H]1O)O)O
Properties
Complexity:
376
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
5
Defined Bond Stereocenter Count:
0
Exact Mass:
314.1g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
314.29g/mol
Monoisotopic Mass:
314.1g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
126A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2
Literature
| Title | Journal |
|---|---|
| Non-smoky glycosyltransferase1 prevents the release of smoky aroma from tomato fruit. | The Plant cell 20130801 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.