| Properties | Image |
|---|
| MNX_ID | MNXM101086 |
 |
| reference | chebi:70195 |
| formula | C20H24O7 |
| global charge | 0 |
| mol weight | 376.405 |
| InChIKey | MWQRAOGWLXTMIC-WZBLMQSHSA-N |
| InChI | InChI=1S/C20H24O7/c1-25-17-7-11(3-5-15(17)22)19(24)14-10-27-20(13(14)9-21)12-4-6-16(23)18(8-12)26-2/h3-8,13-14,19-24H,9-10H2,1-2H3/t13-,14-,19-,20+/m0/s1 |
| SMILES | COC1=C(O)C=CC([C@H]2OC[C@H]([C@@H](O)C3=CC(OC)=C(O)C=C3)[C@@H]2CO)=C1 |
MNX internals
| InChI (mnx) | InChI=1/C20H24O7/c1-25-17-7-11(3-5-15(17)22)19(24)14-10-27-20(13(14)9-21)12-4-6-16(23)18(8-12)26-2/h3-8,13-14,19-24H,9-10H2,1-2H3/t13-,14-,19-,20+/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][O:25][C:17]1=[C:15]([OH:22])[CH:5]=[CH:3][C:11]([C@@H:19]([C@H:14]2[CH2:10][O:27][C@H:20]([C:12]3=[CH:8][C:18]([O:26][CH3:2])=[C:16]([OH:23])[CH:6]=[CH:4]3)[C@H:13]2[CH2:9][OH:21])[OH:24])=[CH:7]1 |
|