| Properties | Image |
|---|
| MNX_ID | MNXM38841 |
 |
| reference | lipidmapsM:LMPK12112826 |
| formula | C24H24O13 |
| global charge | 0 |
| mol weight | 520.443 |
| InChIKey | ZUFMRXXRSIQSPO-ZWOIFGKBSA-N |
| InChI | InChI=1S/C24H24O13/c1-9(25)34-8-14-16(28)19(31)20(32)24(36-14)37-23-18(30)15-13(7-12(27)22(33-2)17(15)29)35-21(23)10-3-5-11(26)6-4-10/h3-7,14,16,19-20,24,26-29,31-32H,8H2,1-2H3/t14-,16-,19+,20-,24+/m1/s1 |
| SMILES | COC1=C(O)C2=C(C=C1O)OC(C1=CC=C(O)C=C1)=C(O[C@@H]1O[C@H](COC(C)=O)[C@@H](O)[C@H](O)[C@H]1O)C2=O |
MNX internals
| InChI (mnx) | InChI=1/C24H24O13/c1-9(25)34-8-14-16(28)19(31)20(32)24(36-14)37-23-18(30)15-13(7-12(27)22(33-2)17(15)29)35-21(23)10-3-5-11(26)6-4-10/h3-7,14,16,19-20,24,26-29,31-32H,8H2,1-2H3/t14-,16-,19+,20-,24+/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][C:9](=[O:25])[O:34][CH2:8][C@@H:14]1[C@@H:16]([OH:28])[C@H:19]([OH:31])[C@@H:20]([OH:32])[C@H:24]([O:37][C:23]2=[C:21]([C:10]3=[CH:4][CH:6]=[C:11]([OH:26])[CH:5]=[CH:3]3)[O:35][C:13]3=[C:15]([C:17]([OH:29])=[C:22]([O:33][CH3:2])[C:12]([OH:27])=[CH:7]3)[C:18]2=[O:30])[O:36]1 |
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