| Properties | Image |
|---|
| MNX_ID | MNXM1185837 |
 |
| reference | envipathM:...4c6068675f27 |
| formula | C37H66O9 |
| global charge | 0 |
| mol weight | 654.926 |
| InChIKey | KBFOYMBZBWSPIE-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H66O9/c1-3-5-6-18-24-33(41)37-34(46-37)25-20-15-13-17-21-26-35(42)44-29-30(28-38)45-36(43)27-22-16-12-10-8-7-9-11-14-19-23-32(40)31(39)4-2/h18-19,23-24,30-34,37-41H,3-17,20-22,25-29H2,1-2H3 |
| SMILES | CCCCC=CC(O)C1OC1CCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCCCCC=CC(O)C(O)CC |
MNX internals
| InChI (mnx) | InChI=1/C37H66O9/c1-3-5-6-18-24-33(41)37-34(46-37)25-20-15-13-17-21-26-35(42)44-29-30(28-38)45-36(43)27-22-16-12-10-8-7-9-11-14-19-23-32(40)31(39)4-2/h18-19,23-24,30-34,37-41H,3-17,20-22,25-29H2,1-2H3/b23-19?,24-18?/t30?,31?,32?,33?,34?,37? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:6][CH:18]=[CH:24][CH:33]([CH:37]1[CH:34]([CH2:25][CH2:20][CH2:15][CH2:13][CH2:17][CH2:21][CH2:26][C:35](=[O:42])[O:44][CH2:29][CH:30]([CH2:28][OH:38])[O:45][C:36]([CH2:27][CH2:22][CH2:16][CH2:12][CH2:10][CH2:8][CH2:7][CH2:9][CH2:11][CH2:14][CH:19]=[CH:23][CH:32]([CH:31]([CH2:4][CH3:2])[OH:39])[OH:40])=[O:43])[O:46]1)[OH:41] |
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