| Properties | Image |
|---|
| MNX_ID | MNXM730858 |
 |
| reference | sabiorkM:28595 |
| formula | C29H34O16 |
| global charge | 0 |
| mol weight | 638.575 |
| InChIKey | ARXPVMZZNQCBIB-UHFFFAOYSA-N |
| InChI | InChI=1S/C29H34O16/c1-36-15-6-19-18(42-11-43-19)4-12(15)14-8-39-16-7-20(17(37-2)5-13(16)22(14)30)44-27-25(33)24(32)23(31)21(45-27)9-40-28-26(34)29(35,38-3)10-41-28/h4-7,14,21,23-28,31-35H,8-11H2,1-3H3 |
| SMILES | COC1=CC2=C(C=C1C1COC3=CC(OC4OC(COC5OCC(O)(OC)C5O)C(O)C(O)C4O)=C(OC)C=C3C1=O)OCO2 |
MNX internals
| InChI (mnx) | InChI=1/C29H34O16/c1-36-15-6-19-18(42-11-43-19)4-12(15)14-8-39-16-7-20(17(37-2)5-13(16)22(14)30)44-27-25(33)24(32)23(31)21(45-27)9-40-28-26(34)29(35,38-3)10-41-28/h4-7,14,21,23-28,31-35H,8-11H2,1-3H3/t14?,21?,23?,24?,25?,26?,27?,28?,29? |
 |
| SMILES (mnx) | [CH3:1][O:36][C:15]1=[CH:6][C:19]2=[C:18]([CH:4]=[C:12]1[CH:14]1[CH2:8][O:39][C:16]3=[CH:7][C:20]([O:44][CH:27]4[CH:25]([OH:33])[CH:24]([OH:32])[CH:23]([OH:31])[CH:21]([CH2:9][O:40][CH:28]5[CH:26]([OH:34])[C:29]([OH:35])([O:38][CH3:3])[CH2:10][O:41]5)[O:45]4)=[C:17]([O:37][CH3:2])[CH:5]=[C:13]3[C:22]1=[O:30])[O:42][CH2:11][O:43]2 |
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