| Properties | Image |
|---|
| MNX_ID | MNXM27978 |
 |
| reference | lipidmapsM:LMPK12111293 |
| formula | C23H24O12 |
| global charge | 0 |
| mol weight | 492.433 |
| InChIKey | JCUIPEIMZRLNKQ-BSTKLLGTSA-N |
| InChI | InChI=1S/C23H24O12/c1-31-14-7-11(26)16-10(25)6-13(33-22(16)21(14)32-2)9-4-3-5-12(17(9)27)34-23-20(30)19(29)18(28)15(8-24)35-23/h3-7,15,18-20,23-24,26-30H,8H2,1-2H3/t15-,18-,19+,20-,23-/m1/s1 |
| SMILES | COC1=C(OC)C2=C(C(=O)C=C(C3=C(O)C(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)=CC=C3)O2)C(O)=C1 |
MNX internals
| InChI (mnx) | InChI=1/C23H24O12/c1-31-14-7-11(26)16-10(25)6-13(33-22(16)21(14)32-2)9-4-3-5-12(17(9)27)34-23-20(30)19(29)18(28)15(8-24)35-23/h3-7,15,18-20,23-24,26-30H,8H2,1-2H3/t15-,18-,19+,20-,23-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][O:31][C:14]1=[CH:7][C:11]([OH:26])=[C:16]2[C:10](=[O:25])[CH:6]=[C:13]([C:9]3=[C:17]([OH:27])[C:12]([O:34][C@H:23]4[C@H:20]([OH:30])[C@@H:19]([OH:29])[C@H:18]([OH:28])[C@@H:15]([CH2:8][OH:24])[O:35]4)=[CH:5][CH:3]=[CH:4]3)[O:33][C:22]2=[C:21]1[O:32][CH3:2] |
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