| Properties | Image |
|---|
| MNX_ID | MNXM24664 |
 |
| reference | lipidmapsM:LMST04010294 |
| formula | C24H40O6 |
| global charge | 0 |
| mol weight | 424.578 |
| InChIKey | IMMADCCLTPCOKH-GCHHHJBESA-N |
| InChI | InChI=1S/C24H40O6/c1-12(4-7-21(29)30)14-5-6-15-22-16(10-20(28)24(14,15)3)23(2)11-19(27)17(25)8-13(23)9-18(22)26/h12-20,22,25-28H,4-11H2,1-3H3,(H,29,30)/t12-,13-,14-,15+,16+,17+,18-,19+,20+,22+,23+,24-/m1/s1 |
| SMILES | C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@H]4C[C@H](O)[C@@H](O)C[C@]4(C)[C@H]3C[C@H](O)[C@]12C |
MNX internals
| InChI (mnx) | InChI=1/C24H40O6/c1-12(4-7-21(29)30)14-5-6-15-22-16(10-20(28)24(14,15)3)23(2)11-19(27)17(25)8-13(23)9-18(22)26/h12-20,22,25-28H,4-11H2,1-3H3,(H,29,30)/t12-,13-,14-,15+,16+,17+,18-,19+,20+,22+,23+,24-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][C@H:12]([CH2:4][CH2:7][C:21](=[O:29])[OH:30])[C@H:14]1[CH2:5][CH2:6][C@H:15]2[C@H:22]3[C@H:16]([CH2:10][C@H:20]([OH:28])[C@:24]12[CH3:3])[C@@:23]1([CH3:2])[CH2:11][C@H:19]([OH:27])[C@@H:17]([OH:25])[CH2:8][C@@H:13]1[CH2:9][C@H:18]3[OH:26] |
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