| Properties | Image |
|---|
| MNX_ID | MNXM114450 |
 |
| reference | metacycM:CPD-14858 |
| formula | C24H26O13 |
| global charge | 0 |
| mol weight | 522.459 |
| InChIKey | CYANQHOGPUFIAL-ZWOIFGKBSA-N |
| InChI | InChI=1S/C24H26O13/c1-32-9-6-11(26)15-13(7-9)35-22(23(34-3)18(15)29)10-4-5-12(33-2)17(28)21(10)37-24-20(31)19(30)16(27)14(8-25)36-24/h4-7,14,16,19-20,24-28,30-31H,8H2,1-3H3/t14-,16-,19+,20-,24+/m1/s1 |
| SMILES | COC1=CC(O)=C2C(=O)C(OC)=C(C3=CC=C(OC)C(O)=C3O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC2=C1 |
MNX internals
| InChI (mnx) | InChI=1/C24H26O13/c1-32-9-6-11(26)15-13(7-9)35-22(23(34-3)18(15)29)10-4-5-12(33-2)17(28)21(10)37-24-20(31)19(30)16(27)14(8-25)36-24/h4-7,14,16,19-20,24-28,30-31H,8H2,1-3H3/t14-,16-,19+,20-,24+/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][O:32][C:9]1=[CH:6][C:11]([OH:26])=[C:15]2[C:13](=[CH:7]1)[O:35][C:22]([C:10]1=[C:21]([O:37][C@H:24]3[C@H:20]([OH:31])[C@@H:19]([OH:30])[C@H:16]([OH:27])[C@@H:14]([CH2:8][OH:25])[O:36]3)[C:17]([OH:28])=[C:12]([O:33][CH3:2])[CH:5]=[CH:4]1)=[C:23]([O:34][CH3:3])[C:18]2=[O:29] |
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