| Properties | Image |
|---|
| MNX_ID | MNXM1131059 |
 |
| reference | lipidmapsM:LMPK12040011 |
| formula | C32H26O10 |
| global charge | 0 |
| mol weight | 570.55 |
| InChIKey | BFPJOJFVZXWMSM-CKROWEISSA-N |
| InChI | InChI=1S/C32H26O10/c1-39-19-9-5-16(6-10-19)32-28(30(38)26-22(36)13-20(40-2)14-24(26)42-32)27-29(37)25-21(35)11-18(34)12-23(25)41-31(27)15-3-7-17(33)8-4-15/h3-14,27-28,31-36H,1-2H3/t27-,28-,31+,32+/m1/s1 |
| SMILES | COC1=CC=C([C@@H]2OC3=C(C(=O)[C@H]2[C@@H]2C(=O)C4=C(O)C=C(O)C=C4O[C@H]2C2=CC=C(O)C=C2)C(O)=CC(OC)=C3)C=C1 |
MNX internals
| InChI (mnx) | InChI=1/C32H26O10/c1-39-19-9-5-16(6-10-19)32-28(30(38)26-22(36)13-20(40-2)14-24(26)42-32)27-29(37)25-21(35)11-18(34)12-23(25)41-31(27)15-3-7-17(33)8-4-15/h3-14,27-28,31-36H,1-2H3/t27-,28-,31+,32+/m1/s1 |
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| SMILES (mnx) | [CH3:1][O:39][C:19]1=[CH:10][CH:6]=[C:16]([C@H:32]2[C@H:28]([C@@H:27]3[C:29](=[O:37])[C:25]4=[C:21]([OH:35])[CH:11]=[C:18]([OH:34])[CH:12]=[C:23]4[O:41][C@H:31]3[C:15]3=[CH:4][CH:8]=[C:17]([OH:33])[CH:7]=[CH:3]3)[C:30](=[O:38])[C:26]3=[C:22]([OH:36])[CH:13]=[C:20]([O:40][CH3:2])[CH:14]=[C:24]3[O:42]2)[CH:5]=[CH:9]1 |
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