| Properties | Image |
|---|
| MNX_ID | MNXM1195687 |
 |
| reference | envipathM:...59b95214dcbd |
| formula | C37H64O10 |
| global charge | 0 |
| mol weight | 668.909 |
| InChIKey | RLROHGLQSPLMKP-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H64O10/c1-2-3-22-32(41)33(42)27-35-34(47-35)23-16-9-7-11-17-24-36(43)45-29-31(28-39)46-37(44)25-18-10-6-4-5-8-14-20-30(40)21-15-12-13-19-26-38/h14-15,20-21,30-31,33-35,38-40,42H,2-13,16-19,22-29H2,1H3 |
| SMILES | CCCCC(=O)C(O)CC1OC1CCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCC=CC(O)C=CCCCCO |
MNX internals
| InChI (mnx) | InChI=1/C37H64O10/c1-2-3-22-32(41)33(42)27-35-34(47-35)23-16-9-7-11-17-24-36(43)45-29-31(28-39)46-37(44)25-18-10-6-4-5-8-14-20-30(40)21-15-12-13-19-26-38/h14-15,20-21,30-31,33-35,38-40,42H,2-13,16-19,22-29H2,1H3/b20-14?,21-15?/t30?,31?,33?,34?,35? |
 |
| SMILES (mnx) | [CH3:1][CH2:2][CH2:3][CH2:22][C:32]([CH:33]([CH2:27][CH:35]1[CH:34]([CH2:23][CH2:16][CH2:9][CH2:7][CH2:11][CH2:17][CH2:24][C:36](=[O:43])[O:45][CH2:29][CH:31]([CH2:28][OH:39])[O:46][C:37]([CH2:25][CH2:18][CH2:10][CH2:6][CH2:4][CH2:5][CH2:8][CH:14]=[CH:20][CH:30]([CH:21]=[CH:15][CH2:12][CH2:13][CH2:19][CH2:26][OH:38])[OH:40])=[O:44])[O:47]1)[OH:42])=[O:41] |
|