| Properties | Image |
|---|
| MNX_ID | MNXM1170209 |
 |
| reference | envipathM:...49847b986722 |
| formula | C37H64O9 |
| global charge | 0 |
| mol weight | 652.91 |
| InChIKey | AUKXBCHBCUWEOM-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H64O9/c1-2-3-4-5-6-7-8-9-10-11-12-14-17-22-31(40)37(42)44-30(28-39)29-43-36(41)25-19-16-13-15-18-23-32-34(45-32)27-35-33(46-35)24-20-21-26-38/h5-6,26,30-35,39-40H,2-4,7-25,27-29H2,1H3 |
| SMILES | CCCCC=CCCCCCCCCCC(O)C(=O)OC(CO)COC(=O)CCCCCCCC1OC1CC1OC1CCCC=O |
MNX internals
| InChI (mnx) | InChI=1/C37H64O9/c1-2-3-4-5-6-7-8-9-10-11-12-14-17-22-31(40)37(42)44-30(28-39)29-43-36(41)25-19-16-13-15-18-23-32-34(45-32)27-35-33(46-35)24-20-21-26-38/h5-6,26,30-35,39-40H,2-4,7-25,27-29H2,1H3/b6-5?/t30?,31?,32?,33?,34?,35? |
 |
| SMILES (mnx) | [CH3:1][CH2:2][CH2:3][CH2:4][CH:5]=[CH:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:14][CH2:17][CH2:22][CH:31]([C:37](=[O:42])[O:44][CH:30]([CH2:28][OH:39])[CH2:29][O:43][C:36]([CH2:25][CH2:19][CH2:16][CH2:13][CH2:15][CH2:18][CH2:23][CH:32]1[CH:34]([CH2:27][CH:35]2[CH:33]([CH2:24][CH2:20][CH2:21][CH:26]=[O:38])[O:46]2)[O:45]1)=[O:41])[OH:40] |
|