| Properties | Image |
|---|
| MNX_ID | MNXM1197568 |
 |
| reference | envipathM:...03bc2d1efca8 |
| formula | C37H64O8 |
| global charge | 0 |
| mol weight | 636.911 |
| InChIKey | QUNNGMJSUHXJNQ-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H64O8/c1-3-5-6-13-19-25-34-35(45-34)26-20-15-12-17-21-27-36(41)43-30-31(29-38)44-37(42)28-22-16-11-9-7-8-10-14-18-24-33(40)32(39)23-4-2/h10,13-14,19,29,31-35,39-40H,3-9,11-12,15-18,20-28,30H2,1-2H3 |
| SMILES | CCCCC=CCC1OC1CCCCCCCC(=O)OCC(C=O)OC(=O)CCCCCCCC=CCCC(O)C(O)CCC |
MNX internals
| InChI (mnx) | InChI=1/C37H64O8/c1-3-5-6-13-19-25-34-35(45-34)26-20-15-12-17-21-27-36(41)43-30-31(29-38)44-37(42)28-22-16-11-9-7-8-10-14-18-24-33(40)32(39)23-4-2/h10,13-14,19,29,31-35,39-40H,3-9,11-12,15-18,20-28,30H2,1-2H3/b14-10?,19-13?/t31?,32?,33?,34?,35? |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:6][CH:13]=[CH:19][CH2:25][CH:34]1[CH:35]([CH2:26][CH2:20][CH2:15][CH2:12][CH2:17][CH2:21][CH2:27][C:36](=[O:41])[O:43][CH2:30][CH:31]([CH:29]=[O:38])[O:44][C:37]([CH2:28][CH2:22][CH2:16][CH2:11][CH2:9][CH2:7][CH2:8][CH:10]=[CH:14][CH2:18][CH2:24][CH:33]([CH:32]([CH2:23][CH2:4][CH3:2])[OH:39])[OH:40])=[O:42])[O:45]1 |
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