| Properties | Image |
|---|
| MNX_ID | MNXM105564 |
 |
| reference | chebi:67733 |
| formula | C26H39NO4 |
| global charge | 0 |
| mol weight | 429.601 |
| InChIKey | JCZZVHJOSFEULF-UTNVMCOPSA-N |
| InChI | InChI=1S/C26H39NO4/c1-18(2)9-6-10-19(3)11-7-12-20(4)13-8-14-21-15-16-23(31-26(21)30-5)22-17-24(28)27-25(22)29/h9,11,13,15,22-23,26H,6-8,10,12,14,16-17H2,1-5H3,(H,27,28,29)/b19-11+,20-13+/t22-,23+,26-/m0/s1 |
| SMILES | CO[C@H]1O[C@@H]([C@@H]2CC(=O)NC2=O)CC=C1CC/C=C(\C)CC/C=C(\C)CCC=C(C)C |
MNX internals
| InChI (mnx) | InChI=1/C26H39NO4/c1-18(2)9-6-10-19(3)11-7-12-20(4)13-8-14-21-15-16-23(31-26(21)30-5)22-17-24(28)27-25(22)29/h9,11,13,15,22-23,26H,6-8,10,12,14,16-17H2,1-5H3,(H,27,28,29)/b19-11+,20-13+/t22-,23+,26-/m0/s1 |
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| SMILES (mnx) | [CH3:1][C:18]([CH3:2])=[CH:9][CH2:6][CH2:10]/[C:19]([CH3:3])=[CH:11]/[CH2:7][CH2:12]/[C:20]([CH3:4])=[CH:13]/[CH2:8][CH2:14][C:21]1=[CH:15][CH2:16][C@H:23]([C@@H:22]2[CH2:17][C:24]([OH:28])=[N:27][C:25]2=[O:29])[O:31][C@@H:26]1[O:30][CH3:5] |
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