| SpectraBase Spectrum ID |
J0uv6YXgstP |
| Name |
5,2',6'-Trihydroxy-7,8-dimethoxyflavone 2'-o-.beta.,D-glucuronopyranoside |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
506.106040755 u |
| Formula |
C23H22O13 |
| InChI |
InChI=1S/C23H22O13/c1-32-13-7-10(26)14-9(25)6-12(34-20(14)19(13)33-2)15-8(24)4-3-5-11(15)35-23-18(29)16(27)17(28)21(36-23)22(30)31/h3-7,16-18,21,23-24,26-29H,1-2H3,(H,30,31)/t16-,17-,18+,21-,23-/m0/s1 |
| InChIKey |
MBIYPXWFHDINAY-KOONPVMTSA-N |
| Molecular Weight |
506.416 g/mol |
| SMILES |
C=1(OC2=C(C(OC)=CC(=C2C(C1)=O)O)OC)C=1C(O[C@]2(O[C@](C(=O)O)([C@]([C@@]([C@]2(O)[H])(O)[H])(O)[H])[H])[H])=CC=CC1O |
