Catalogue Number: CD866
Caffeic acid 3-O-β-D-glucuronide
5-(2-Carboxyethenyl)-2-hydroxyphenyl-β-D-glucopyranosiduronic acid
Categories
Properties
- CAS Number
- 1093679-73-2
- Molecular Formula
- C15H16O10
- Molecular Weight
- 356.28
- Chemical Purity
- Min. 98% [1H-NMR]
- Appearance
- Beige Amorphous Solid
- Solubility
- H2O
Regulatory
- SDS
- SDS PDF (New Window)
- Search for COA
-
- DSL Status (Canada)
- None
- TSCA Certification (United States)
- Negative Certification
- RTECS Number
- N/A
Storage & Shipping
- Storage
- Store at 0 to -20 °C.
- Shipping Conditions
- Ambient, Express Only
- Tariff Code (United States)
- 2938900000
Safety
Not a dangerous substance according to GHS.
Search Terms
IUPAC Name
(2S,3S,4S,5R,6S)-6-{5-[(E)-2-Carboxyethenyl]-2-hydroxyphenoxy}-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
InChI
InChI=1S/C15H16O10/c16-7-3-1-6(2-4-9(17)18)5-8(7)24-15-12(21)10(19)11(20)13(25-15)14(22)23/h1-5,10-13,15-16,19-21H,(H,17,18)(H,22,23)/b4-2+/t10-,11-,12+,13-,15+/m0/s1
InChI Key
BSOMSDFTZKNUHY-ZYZFHZPYSA-N
Smiles
C(=O)(O)/C=C/C=1C=CC(=C(O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O)C1)O