| Properties | Image |
|---|
| MNX_ID | MNXM114448 |
 |
| reference | metacycM:CPD-14864 |
| formula | C26H30O14 |
| global charge | 0 |
| mol weight | 566.512 |
| InChIKey | WMFKOOZSWDLSGH-SMEJDQOCSA-N |
| InChI | InChI=1S/C26H30O14/c1-33-11-7-6-10(21(35-3)24(11)40-26-20(32)19(31)16(28)14(9-27)39-26)22-25(37-5)18(30)15-12(38-22)8-13(34-2)23(36-4)17(15)29/h6-8,14,16,19-20,26-29,31-32H,9H2,1-5H3/t14-,16-,19+,20-,26+/m1/s1 |
| SMILES | COC1=CC=C(C2=C(OC)C(=O)C3=C(O)C(OC)=C(OC)C=C3O2)C(OC)=C1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C26H30O14/c1-33-11-7-6-10(21(35-3)24(11)40-26-20(32)19(31)16(28)14(9-27)39-26)22-25(37-5)18(30)15-12(38-22)8-13(34-2)23(36-4)17(15)29/h6-8,14,16,19-20,26-29,31-32H,9H2,1-5H3/t14-,16-,19+,20-,26+/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][O:33][C:11]1=[C:24]([O:40][C@H:26]2[C@H:20]([OH:32])[C@@H:19]([OH:31])[C@H:16]([OH:28])[C@@H:14]([CH2:9][OH:27])[O:39]2)[C:21]([O:35][CH3:3])=[C:10]([C:22]2=[C:25]([O:37][CH3:5])[C:18](=[O:30])[C:15]3=[C:17]([OH:29])[C:23]([O:36][CH3:4])=[C:13]([O:34][CH3:2])[CH:8]=[C:12]3[O:38]2)[CH:6]=[CH:7]1 |
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