3-[(2-O-D-Apio-β-D-furanosyl-β-D-glucopyranosyl)oxy]-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
CAS Registry Number®
99816-59-8
CAS Name
3-[(2-O-D-Apio-β-D-furanosyl-β-D-glucopyranosyl)oxy]-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-oneMolecular Formula
C26H28O15Molecular Mass
580.49Cite this Page
3-[(2-O-D-Apio-β-D-furanosyl-β-D-glucopyranosyl)oxy]-5,7-dihydroxy-2-(4-hydroxyphenyl)-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=99816-59-8 (retrieved ) (CAS RN: 99816-59-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C26H28O15/c27-7-15-17(32)19(34)22(41-25-23(35)26(36,8-28)9-37-25)24(39-15)40-21-18(33)16-13(31)5-12(30)6-14(16)38-20(21)10-1-3-11(29)4-2-10/h1-6,15,17,19,22-25,27-32,34-36H,7-9H2/t15-,17-,19+,22-,23+,24+,25+,26-/m1/s1
InChIKey
InChIKey=MNBRHJWOHPGQIW-CFSZRLFJSA-N
SMILES
O(C1=C(OC=2C(C1=O)=C(O)C=C(O)C2)C3=CC=C(O)C=C3)[C@H]4[C@H](O[C@H]5[C@H](O)[C@](CO)(O)CO5)[C@@H](O)[C@H](O)[C@@H](CO)O4
Canonical SMILES
O=C1C(OC2OC(CO)C(O)C(O)C2OC3OCC(O)(CO)C3O)=C(OC=4C=C(O)C=C(O)C14)C=5C=CC(O)=CC5
Other Names for this Substance
- 4H-1-Benzopyran-4-one, 3-[(2-O-D-apio-β-D-furanosyl-β-D-glucopyranosyl)oxy]-5,7-dihydroxy-2-(4-hydroxyphenyl)-
- 3-[(2-O-D-Apio-β-D-furanosyl-β-D-glucopyranosyl)oxy]-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one