| Properties | Image |
|---|
| MNX_ID | MNXM1183005 |
 |
| reference | envipathM:...7fe2ac8c3962 |
| formula | C37H64O10 |
| global charge | 0 |
| mol weight | 668.909 |
| InChIKey | KKUZGMPOXAQJKW-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H64O10/c1-3-5-20-32-34(46-32)25-35-33(47-35)21-15-12-11-14-19-31(41)37(43)44-27-30(26-38)45-36(42)22-16-10-8-6-7-9-13-18-29(40)24-23-28(39)17-4-2/h13,18,23-24,28-35,38-41H,3-12,14-17,19-22,25-27H2,1-2H3 |
| SMILES | CCCCC1OC1CC1OC1CCCCCCC(O)C(=O)OCC(CO)OC(=O)CCCCCCCC=CC(O)C=CC(O)CCC |
MNX internals
| InChI (mnx) | InChI=1/C37H64O10/c1-3-5-20-32-34(46-32)25-35-33(47-35)21-15-12-11-14-19-31(41)37(43)44-27-30(26-38)45-36(42)22-16-10-8-6-7-9-13-18-29(40)24-23-28(39)17-4-2/h13,18,23-24,28-35,38-41H,3-12,14-17,19-22,25-27H2,1-2H3/b18-13?,24-23?/t28?,29?,30?,31?,32?,33?,34?,35? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:20][CH:32]1[CH:34]([CH2:25][CH:35]2[CH:33]([CH2:21][CH2:15][CH2:12][CH2:11][CH2:14][CH2:19][CH:31]([C:37](=[O:43])[O:44][CH2:27][CH:30]([CH2:26][OH:38])[O:45][C:36]([CH2:22][CH2:16][CH2:10][CH2:8][CH2:6][CH2:7][CH2:9][CH:13]=[CH:18][CH:29]([CH:24]=[CH:23][CH:28]([CH2:17][CH2:4][CH3:2])[OH:39])[OH:40])=[O:42])[OH:41])[O:47]2)[O:46]1 |
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