| Properties | Image |
| MNX_ID | MNXM44934 |
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| reference | lipidmapsM:LMPK12140350 |
| formula | C26H30O6 |
| global charge | 0 |
| mol weight | 438.52 |
| InChIKey | BOBWTYODGOYWRC-UVIRAJKCSA-N |
| InChI | InChI=1S/C26H30O6/c1-15(2)6-7-16-10-18(11-17(25(16)31-5)8-9-26(3,4)30)22-14-21(29)24-20(28)12-19(27)13-23(24)32-22/h6,8-13,22,27-28,30H,7,14H2,1-5H3/b9-8+/t22-/m0/s1 |
| SMILES | COC1=C(/C=C/C(C)(C)O)C=C([C@@H]2CC(=O)C3=C(C=C(O)C=C3O)O2)C=C1CC=C(C)C |
MNX internals
| InChI (mnx) | InChI=1/C26H30O6/c1-15(2)6-7-16-10-18(11-17(25(16)31-5)8-9-26(3,4)30)22-14-21(29)24-20(28)12-19(27)13-23(24)32-22/h6,8-13,22,27-28,30H,7,14H2,1-5H3/b9-8+/t22-/m0/s1 |
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| SMILES (mnx) | [CH3:1][C:15]([CH3:2])=[CH:6][CH2:7][C:16]1=[CH:10][C:18]([C@@H:22]2[CH2:14][C:21](=[O:29])[C:24]3=[C:20]([OH:28])[CH:12]=[C:19]([OH:27])[CH:13]=[C:23]3[O:32]2)=[CH:11][C:17](/[CH:8]=[CH:9]/[C:26]([CH3:3])([CH3:4])[OH:30])=[C:25]1[O:31][CH3:5] |
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