β-D-Glucopyranose 6-[(2E)-3-phenyl-2-propenoate] 1,2-bis(3,4,5-trihydroxybenzoate)
CAS Registry Number®
115746-70-8
CAS Name
β-D-Glucopyranose 6-[(2E)-3-phenyl-2-propenoate] 1,2-bis(3,4,5-trihydroxybenzoate)Molecular Formula
C29H26O15Molecular Mass
614.51Cite this Page
β-D-Glucopyranose 6-[(2E)-3-phenyl-2-propenoate] 1,2-bis(3,4,5-trihydroxybenzoate). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=115746-70-8 (retrieved ) (CAS RN: 115746-70-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C29H26O15/c30-16-8-14(9-17(31)22(16)35)27(39)43-26-25(38)24(37)20(12-41-21(34)7-6-13-4-2-1-3-5-13)42-29(26)44-28(40)15-10-18(32)23(36)19(33)11-15/h1-11,20,24-26,29-33,35-38H,12H2/b7-6+/t20-,24-,25+,26-,29+/m1/s1
InChIKey
InChIKey=QAVVLMYACCQGJA-MUZYTARRSA-N
SMILES
O(C(=O)C1=CC(O)=C(O)C(O)=C1)[C@H]2[C@H](OC(=O)C3=CC(O)=C(O)C(O)=C3)O[C@H](COC(/C=C/C4=CC=CC=C4)=O)[C@@H](O)[C@@H]2O
Canonical SMILES
O=C(OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C(O)C1O)C=CC=4C=CC=CC4
Other Names for this Substance
- β-D-Glucopyranose, 6-[(2E)-3-phenyl-2-propenoate] 1,2-bis(3,4,5-trihydroxybenzoate)
- β-D-Glucopyranose, 6-(3-phenyl-2-propenoate) 1,2-bis(3,4,5-trihydroxybenzoate), (E)-
- β-D-Glucopyranose 6-[(2E)-3-phenyl-2-propenoate] 1,2-bis(3,4,5-trihydroxybenzoate)