| Properties | Image |
|---|
| MNX_ID | MNXM14130 |
 |
| reference | keggC:C10221 |
| formula | C30H26O12 |
| global charge | 0 |
| mol weight | 578.526 |
| InChIKey | XFZJEEAOWLFHDH-DQPHOHOGSA-N |
| InChI | InChI=1S/C30H26O12/c31-13-7-20(37)24-23(8-13)41-29(12-2-4-16(33)19(36)6-12)27(40)26(24)25-21(38)10-17(34)14-9-22(39)28(42-30(14)25)11-1-3-15(32)18(35)5-11/h1-8,10,22,26-29,31-40H,9H2/t22-,26+,27+,28-,29+/m0/s1 |
| SMILES | OC1=CC(O)=C2C(=C1)O[C@H](C1=CC(O)=C(O)C=C1)[C@H](O)[C@H]2C1=C(O)C=C(O)C2=C1O[C@@H](C1=CC(O)=C(O)C=C1)[C@@H](O)C2 |
MNX internals
| InChI (mnx) | InChI=1/C30H26O12/c31-13-7-20(37)24-23(8-13)41-29(12-2-4-16(33)19(36)6-12)27(40)26(24)25-21(38)10-17(34)14-9-22(39)28(42-30(14)25)11-1-3-15(32)18(35)5-11/h1-8,10,22,26-29,31-40H,9H2/t22-,26+,27+,28-,29+/m0/s1 |
 |
| SMILES (mnx) | [CH:1]1=[CH:3][C:15]([OH:32])=[C:18]([OH:35])[CH:5]=[C:11]1[C@H:28]1[C@@H:22]([OH:39])[CH2:9][C:14]2=[C:30]([C:25]([C@H:26]3[C:24]4=[C:20]([OH:37])[CH:7]=[C:13]([OH:31])[CH:8]=[C:23]4[O:41][C@H:29]([C:12]4=[CH:6][C:19]([OH:36])=[C:16]([OH:33])[CH:4]=[CH:2]4)[C@@H:27]3[OH:40])=[C:21]([OH:38])[CH:10]=[C:17]2[OH:34])[O:42]1 |
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