[1]Benzopyrano[5,4,3-cde][1]benzopyran-5,10-dione, 2-[(4-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]-7-hydroxy-3,8-dimethoxy-
CAS Registry Number®
113963-57-8
CAS Name
[1]Benzopyrano[5,4,3-cde][1]benzopyran-5,10-dione, 2-[(4-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]-7-hydroxy-3,8-dimethoxy-Molecular Formula
C28H30O18Molecular Mass
654.53Cite this Page
[1]Benzopyrano[5,4,3-cde][1]benzopyran-5,10-dione, 2-[(4-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]-7-hydroxy-3,8-dimethoxy-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=113963-57-8 (retrieved ) (CAS RN: 113963-57-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C28H30O18/c1-39-20-9(31)3-7-13-14-8(26(38)44-23(13)20)4-10(22(40-2)24(14)45-25(7)37)41-27-19(36)17(34)21(12(6-30)43-27)46-28-18(35)16(33)15(32)11(5-29)42-28/h3-4,11-12,15-19,21,27-36H,5-6H2,1-2H3/t11-,12-,15+,16+,17-,18-,19-,21-,27-,28+/m1/s1
InChIKey
InChIKey=NPSMQMOQUDNLHU-HIKDYMEGSA-N
SMILES
O(C)C=1C2=C3C4=C(C(OC)=C(O)C=C4C(=O)O2)OC(=O)C3=CC1O[C@@H]5O[C@H](CO)[C@@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O
Canonical SMILES
O=C1OC=2C(OC)=C(OC3OC(CO)C(OC4OC(CO)C(O)C(O)C4O)C(O)C3O)C=C5C(=O)OC6=C(OC)C(O)=CC1=C6C25
Other Names for this Substance
- [1]Benzopyrano[5,4,3-cde][1]benzopyran-5,10-dione, 2-[(4-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]-7-hydroxy-3,8-dimethoxy-