| Properties | Image |
| MNX_ID | MNXM22900 |
 |
| reference | lipidmapsM:LMPK12140134 |
| formula | C26H30O12 |
| global charge | 0 |
| mol weight | 534.514 |
| InChIKey | KOZCDRWEXYNWCQ-VDUMXKSLSA-N |
| InChI | InChI=1S/C26H30O12/c1-11-16(8-18-19(20(11)30)13(27)7-17(36-18)12-5-3-2-4-6-12)37-26-23(33)24(15(29)10-35-26)38-25-22(32)21(31)14(28)9-34-25/h2-6,8,14-15,17,21-26,28-33H,7,9-10H2,1H3/t14-,15-,17?,21+,22-,23-,24+,25+,26+/m1/s1 |
| SMILES | CC1=C(O[C@@H]2OC[C@@H](O)[C@H](O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@H]2O)C=C2OC(C3=CC=CC=C3)CC(=O)C2=C1O |
MNX internals
| InChI (mnx) | InChI=1/C26H30O12/c1-11-16(8-18-19(20(11)30)13(27)7-17(36-18)12-5-3-2-4-6-12)37-26-23(33)24(15(29)10-35-26)38-25-22(32)21(31)14(28)9-34-25/h2-6,8,14-15,17,21-26,28-33H,7,9-10H2,1H3/t14-,15-,17?,21+,22-,23-,24+,25+,26+/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][C:11]1=[C:16]([O:37][C@H:26]2[C@H:23]([OH:33])[C@@H:24]([O:38][C@H:25]3[C@H:22]([OH:32])[C@@H:21]([OH:31])[C@H:14]([OH:28])[CH2:9][O:34]3)[C@H:15]([OH:29])[CH2:10][O:35]2)[CH:8]=[C:18]2[C:19](=[C:20]1[OH:30])[C:13](=[O:27])[CH2:7][CH:17]([C:12]1=[CH:5][CH:3]=[CH:2][CH:4]=[CH:6]1)[O:36]2 |
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