| Properties | Image |
|---|
| MNX_ID | MNXM1176192 |
 |
| reference | envipathM:...9989a293dfd8 |
| formula | C37H62O9 |
| global charge | 0 |
| mol weight | 650.894 |
| InChIKey | XTHGBNXJYQRICE-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H62O9/c1-2-3-4-9-15-24-34-35(46-34)25-16-11-8-13-17-26-36(42)44-30-33(29-39)45-37(43)27-18-12-7-5-6-10-14-21-31(40)22-19-20-23-32(41)28-38/h9,14-15,19,21-22,32-35,38-39,41H,2-8,10-13,16-18,20,23-30H2,1H3 |
| SMILES | CCCCC=CCC1OC1CCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCC=CC(=O)C=CCCC(O)CO |
MNX internals
| InChI (mnx) | InChI=1/C37H62O9/c1-2-3-4-9-15-24-34-35(46-34)25-16-11-8-13-17-26-36(42)44-30-33(29-39)45-37(43)27-18-12-7-5-6-10-14-21-31(40)22-19-20-23-32(41)28-38/h9,14-15,19,21-22,32-35,38-39,41H,2-8,10-13,16-18,20,23-30H2,1H3/b15-9?,21-14?,22-19?/t32?,33?,34?,35? |
 |
| SMILES (mnx) | [CH3:1][CH2:2][CH2:3][CH2:4][CH:9]=[CH:15][CH2:24][CH:34]1[CH:35]([CH2:25][CH2:16][CH2:11][CH2:8][CH2:13][CH2:17][CH2:26][C:36](=[O:42])[O:44][CH2:30][CH:33]([CH2:29][OH:39])[O:45][C:37]([CH2:27][CH2:18][CH2:12][CH2:7][CH2:5][CH2:6][CH2:10][CH:14]=[CH:21][C:31]([CH:22]=[CH:19][CH2:20][CH2:23][CH:32]([CH2:28][OH:38])[OH:41])=[O:40])=[O:43])[O:46]1 |
|