| Properties | Image |
| MNX_ID | MNXM164037 |
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| reference | biggM:CE6504 |
| formula | C18H32O6 |
| global charge | 0 |
| mol weight | 344.448 |
| InChIKey | UPKSZTNLXJIVNV-DTQAZKPQSA-N |
| InChI | InChI=1S/C18H32O6/c1-2-3-7-10-15-16(23-15)13-14-22-18(24-21)12-9-6-4-5-8-11-17(19)20/h13,15,18,21H,2-12,14H2,1H3,(H,19,20)/b16-13+ |
| SMILES | CCCCCC1O/C1=C/COC(CCCCCCCC(=O)O)OO |
MNX internals
| InChI (mnx) | InChI=1/C18H32O6/c1-2-3-7-10-15-16(23-15)13-14-22-18(24-21)12-9-6-4-5-8-11-17(19)20/h13,15,18,21H,2-12,14H2,1H3,(H,19,20)/b16-13+/t15?,18? |
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| SMILES (mnx) | [CH3:1][CH2:2][CH2:3][CH2:7][CH2:10][CH:15]1/[C:16](=[CH:13]\[CH2:14][O:22][CH:18]([CH2:12][CH2:9][CH2:6][CH2:4][CH2:5][CH2:8][CH2:11][C:17](=[O:19])[OH:20])[O:24][OH:21])[O:23]1 |
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