| Properties | Image |
|---|
| MNX_ID | MNXM1177054 |
 |
| reference | envipathM:...bc65f98938f2 |
| formula | C20H34O7 |
| global charge | 0 |
| mol weight | 386.485 |
| InChIKey | UJQIXODPUFOOEL-UHFFFAOYSA-N |
| InChI | InChI=1S/C20H34O7/c1-2-16(23)17(24)9-8-11-19-18(27-19)10-6-4-3-5-7-12-20(25)26-14-15(22)13-21/h8-9,16-19,21,23-24H,2-7,10-14H2,1H3 |
| SMILES | CCC(O)C(O)C=CCC1OC1CCCCCCCC(=O)OCC(=O)CO |
MNX internals
| InChI (mnx) | InChI=1/C20H34O7/c1-2-16(23)17(24)9-8-11-19-18(27-19)10-6-4-3-5-7-12-20(25)26-14-15(22)13-21/h8-9,16-19,21,23-24H,2-7,10-14H2,1H3/b9-8?/t16?,17?,18?,19? |
 |
| SMILES (mnx) | [CH3:1][CH2:2][CH:16]([CH:17]([CH:9]=[CH:8][CH2:11][CH:19]1[CH:18]([CH2:10][CH2:6][CH2:4][CH2:3][CH2:5][CH2:7][CH2:12][C:20](=[O:25])[O:26][CH2:14][C:15]([CH2:13][OH:21])=[O:22])[O:27]1)[OH:24])[OH:23] |
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