| Properties | Image |
|---|
| MNX_ID | MNXM164063 |
 |
| reference | biggM:CE6438 |
| formula | C22H31O4 |
| global charge | -1 |
| mol weight | 359.486 |
| InChIKey | CKZSGIYGQCNFBU-YCKILXMLSA-M |
| InChI | InChI=1S/C22H32O4/c1-2-3-4-15-18-21(26-25)19-16-13-11-9-7-5-6-8-10-12-14-17-20-22(23)24/h3-4,6-9,12-16,18,21,25H,2,5,10-11,17,19-20H2,1H3,(H,23,24)/p-1/b4-3+,8-6+,9-7+,14-12+,16-13+,18-15+ |
| SMILES | CC/C=C/C=C/C(C/C=C/C/C=C/C/C=C/C/C=C/CCC(=O)[O-])OO |
MNX internals
| InChI (mnx) | InChI=1/C22H32O4/c1-2-3-4-15-18-21(26-25)19-16-13-11-9-7-5-6-8-10-12-14-17-20-22(23)24/h3-4,6-9,12-16,18,21,25H,2,5,10-11,17,19-20H2,1H3,(H,23,24)/b4-3+,8-6+,9-7+,14-12+,16-13+,18-15+/t21? |
 |
| SMILES (mnx) | [CH3:1][CH2:2]/[CH:3]=[CH:4]/[CH:15]=[CH:18]/[CH:21]([CH2:19]/[CH:16]=[CH:13]/[CH2:11]/[CH:9]=[CH:7]/[CH2:5]/[CH:6]=[CH:8]/[CH2:10]/[CH:12]=[CH:14]/[CH2:17][CH2:20][C:22](=[O:23])[OH:24])[O:26][OH:25] |
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