5-[[2-O-(6-Deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-3-(3,4-dimethoxyphenyl)-7-methoxy-8-methyl-4H-1-benzopyran-4-one
CAS Registry Number®
87611-94-7
CAS Name
5-[[2-O-(6-Deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-3-(3,4-dimethoxyphenyl)-7-methoxy-8-methyl-4H-1-benzopyran-4-oneMolecular Formula
C31H38O15Molecular Mass
650.62Cite this Page
5-[[2-O-(6-Deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-3-(3,4-dimethoxyphenyl)-7-methoxy-8-methyl-4H-1-benzopyran-4-one. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=87611-94-7 (retrieved ) (CAS RN: 87611-94-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C31H38O15/c1-12-17(40-4)9-19(21-23(34)15(11-42-28(12)21)14-6-7-16(39-3)18(8-14)41-5)44-31-29(26(37)24(35)20(10-32)45-31)46-30-27(38)25(36)22(33)13(2)43-30/h6-9,11,13,20,22,24-27,29-33,35-38H,10H2,1-5H3/t13-,20+,22-,24+,25+,26-,27+,29+,30-,31+/m0/s1
InChIKey
InChIKey=HBIBVIWVUMZFQY-ZUEUIZSRSA-N
SMILES
O(C1=C2C(=C(C)C(OC)=C1)OC=C(C2=O)C3=CC(OC)=C(OC)C=C3)[C@H]4[C@H](O[C@H]5[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O5)[C@@H](O)[C@H](O)[C@@H](CO)O4
Canonical SMILES
O=C1C(=COC2=C1C(OC3OC(CO)C(O)C(O)C3OC4OC(C)C(O)C(O)C4O)=CC(OC)=C2C)C=5C=CC(OC)=C(OC)C5
Other Names for this Substance
- 4H-1-Benzopyran-4-one, 5-[[2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-3-(3,4-dimethoxyphenyl)-7-methoxy-8-methyl-
- 5-[[2-O-(6-Deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-3-(3,4-dimethoxyphenyl)-7-methoxy-8-methyl-4H-1-benzopyran-4-one