| Properties | Image |
|---|
| MNX_ID | MNXM321352 |
 |
| reference | slm:000500545 |
| formula | C45H80O10 |
| global charge | 0 |
| mol weight | 781.125 |
| InChIKey | CXMFYMRNDZMDGC-UKPJNRNKSA-N |
| InChI | InChI=1S/C45H80O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,38-39,42-46,49-51H,3-4,6,8-10,12,14-16,18,20-37H2,1-2H3/b7-5-,13-11-,19-17-/t38-,39-,42+,43+,44-,45-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C45H80O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,38-39,42-46,49-51H,3-4,6,8-10,12,14-16,18,20-37H2,1-2H3/b7-5-,13-11-,19-17-/t38-,39-,42+,43+,44-,45-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21][CH2:23][CH2:25][CH2:27][CH2:29][CH2:31][CH2:33][C:40](=[O:47])[O:52][CH2:36][C@H:38]([CH2:37][O:53][C@H:45]1[C@H:44]([OH:51])[C@@H:43]([OH:50])[C@@H:42]([OH:49])[C@@H:39]([CH2:35][OH:46])[O:55]1)[O:54][C:41]([CH2:34][CH2:32][CH2:30][CH2:28][CH2:26][CH2:24][CH2:22][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:48] |
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