| Properties | Image |
|---|
| MNX_ID | MNXM102363 |
 |
| reference | chebi:65368 |
| formula | C26H44O5 |
| global charge | 0 |
| mol weight | 436.633 |
| InChIKey | UBFNRKJKPNNCHD-JMTTVTNBSA-N |
| InChI | InChI=1S/C26H44O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-23-18-22(28)20-26(30-23)17-16-25(31-26)15-14-21(27)19-24(25)29/h14-15,22-24,28-29H,2-13,16-20H2,1H3/t22-,23-,24+,25+,26+/m1/s1 |
| SMILES | CCCCCCCCCCCCC[C@@H]1C[C@@H](O)C[C@@]2(CC[C@]3(C=CC(=O)C[C@@H]3O)O2)O1 |
MNX internals
| InChI (mnx) | InChI=1/C26H44O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-23-18-22(28)20-26(30-23)17-16-25(31-26)15-14-21(27)19-24(25)29/h14-15,22-24,28-29H,2-13,16-20H2,1H3/t22-,23-,24+,25+,26+/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][C@@H:23]1[CH2:18][C@@H:22]([OH:28])[CH2:20][C@@:26]2([CH2:17][CH2:16][C@:25]3([CH:15]=[CH:14][C:21](=[O:27])[CH2:19][C@@H:24]3[OH:29])[O:31]2)[O:30]1 |
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