| Properties | Image |
|---|
| MNX_ID | MNXM1132020 |
 |
| reference | lipidmapsM:LMST01130070 |
| formula | C24H32O6 |
| global charge | 0 |
| mol weight | 416.514 |
| InChIKey | SOGONHOGEFLVPE-PUVOGLICSA-N |
| InChI | InChI=1S/C24H32O6/c1-22-9-7-15(25)11-14(22)4-5-17-19(22)20(27)21(28)23(2)16(8-10-24(17,23)29)13-3-6-18(26)30-12-13/h3,6,12,14-17,19,21,25,28-29H,4-5,7-11H2,1-2H3/t14-,15+,16-,17-,19-,21-,22+,23+,24+/m1/s1 |
| SMILES | C[C@]12CC[C@H](O)C[C@H]1CC[C@@H]1[C@@H]2C(=O)[C@@H](O)[C@]2(C)[C@@H](C3=COC(=O)C=C3)CC[C@]12O |
MNX internals
| InChI (mnx) | InChI=1/C24H32O6/c1-22-9-7-15(25)11-14(22)4-5-17-19(22)20(27)21(28)23(2)16(8-10-24(17,23)29)13-3-6-18(26)30-12-13/h3,6,12,14-17,19,21,25,28-29H,4-5,7-11H2,1-2H3/t14-,15+,16-,17-,19-,21-,22+,23+,24+/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][C@:22]12[CH2:9][CH2:7][C@H:15]([OH:25])[CH2:11][C@H:14]1[CH2:4][CH2:5][C@@H:17]1[C@@H:19]2[C:20](=[O:27])[C@@H:21]([OH:28])[C@:23]2([CH3:2])[C@@H:16]([C:13]3=[CH:12][O:30][C:18](=[O:26])[CH:6]=[CH:3]3)[CH2:8][CH2:10][C@:24]12[OH:29] |
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