| Properties | Image |
| MNX_ID | MNXM102173 |
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| reference | lipidmapsM:LMFA03110170 |
| formula | C22H38O5 |
| global charge | 0 |
| mol weight | 382.541 |
| InChIKey | QILWIJCKQCKOMR-LSEOUJGGSA-N |
| InChI | InChI=1S/C22H38O5/c1-2-3-4-5-6-9-12-18-19(21(25)16-20(18)24)15-14-17(23)11-8-7-10-13-22(26)27/h6,9,14-15,17-21,23-25H,2-5,7-8,10-13,16H2,1H3,(H,26,27)/b9-6-,15-14+ |
| SMILES | CCCCC/C=C\CC1C(O)CC(O)C1/C=C/C(O)CCCCCC(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C22H38O5/c1-2-3-4-5-6-9-12-18-19(21(25)16-20(18)24)15-14-17(23)11-8-7-10-13-22(26)27/h6,9,14-15,17-21,23-25H,2-5,7-8,10-13,16H2,1H3,(H,26,27)/b9-6-,15-14+/t17?,18?,19?,20?,21? |
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| SMILES (mnx) | [CH3:1][CH2:2][CH2:3][CH2:4][CH2:5]/[CH:6]=[CH:9]\[CH2:12][CH:18]1[CH:19](/[CH:15]=[CH:14]/[CH:17]([CH2:11][CH2:8][CH2:7][CH2:10][CH2:13][C:22](=[O:26])[OH:27])[OH:23])[CH:21]([OH:25])[CH2:16][CH:20]1[OH:24] |
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