| Properties | Image |
MNX_ID | MNXM324232 |
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reference | slm:000500492 |
formula | C41H72O10 |
global charge | 0 |
mol weight | 725.017 |
InChIKey | ARZFUJTVCIDWLT-IHTXYNRMSA-N |
InChI | InChI=1S/C41H72O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-36(43)48-32-34(33-49-41-40(47)39(46)38(45)35(31-42)51-41)50-37(44)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h7,9,13-16,34-35,38-42,45-47H,3-6,8,10-12,17-33H2,1-2H3/b9-7-,15-13-,16-14-/t34-,35-,38+,39+,40-,41-/m1/s1 |
SMILES | CCC/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)CCCCCCC/C=C\CCCCCC |
MNX internals
InChI (mnx) | InChI=1/C41H72O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-36(43)48-32-34(33-49-41-40(47)39(46)38(45)35(31-42)51-41)50-37(44)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h7,9,13-16,34-35,38-42,45-47H,3-6,8,10-12,17-33H2,1-2H3/b9-7-,15-13-,16-14-/t34-,35-,38+,39+,40-,41-/m1/s1 |
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SMILES (mnx) | [CH3:1][CH2:3][CH2:5]/[CH:7]=[CH:9]\[CH2:11]/[CH:13]=[CH:15]\[CH2:17][CH2:19][CH2:21][CH2:23][CH2:25][CH2:27][CH2:29][C:36](=[O:43])[O:48][CH2:32][C@H:34]([CH2:33][O:49][C@H:41]1[C@H:40]([OH:47])[C@@H:39]([OH:46])[C@@H:38]([OH:45])[C@@H:35]([CH2:31][OH:42])[O:51]1)[O:50][C:37]([CH2:30][CH2:28][CH2:26][CH2:24][CH2:22][CH2:20][CH2:18]/[CH:16]=[CH:14]\[CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:44] |
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