Product Identifiers
Catalog # | NX37510 |
CAS Number | 24959-81-7 |
PubChem CID | 5281759 |
Chemical Name | Caffeic acid 3-O-beta-D-glucopyranoside |
IUPAC Name | (E)-3-[4-hydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoic acid |
Synonym | 3,4-Dihydroxycinnamic acid 3-O-beta-D-glucopyranoside, 3-[3-(beta-D-Glucopyranosyloxy)-4-hydroxyphenyl]-2-propenoic acid |
InChI | InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(24-10)23-9-5-7(1-3-8(9)17)2-4-11(18)19/h1-5,10,12-17,20-22H,6H2,(H,18,19)/b4-2+/t10-,12-,13+,14-,15-/m1/s1 |
InChIKey | QOPSZFXPZWQLOG-VHCZEJTMSA-N |
SMILES | OC[C@H]1O[C@@H](Oc2cc(\C=C\C(=O)O)ccc2O)[C@H](O)[C@@H](O)[C@@H]1O |
MDL Number | MFCD28122836 |
Specification
MW | 342.3 |
MF | C15H18O9 |
Assay | >98% |
Cat Number | BICL4281 |
Manufacturer | Apollo Scientific |
Country of Origin | United Kingdom |