| Properties | Image |
|---|
| MNX_ID | MNXM108430 |
 |
| reference | chebi:67679 |
| formula | C20H28O6 |
| global charge | 0 |
| mol weight | 364.438 |
| InChIKey | DWBNAAUVBIEEOE-PGBLAOAPSA-N |
| InChI | InChI=1S/C20H28O6/c1-9-10-5-6-11-18-8-4-7-17(2,3)12(18)15(23)20(25,26-16(18)24)19(11,13(9)21)14(10)22/h10-15,21-23,25H,1,4-8H2,2-3H3/t10-,11+,12-,13-,14-,15+,18-,19+,20-/m1/s1 |
| SMILES | C=C1[C@H]2CC[C@H]3[C@]45CCCC(C)(C)[C@H]4[C@H](O)[C@@](O)(OC5=O)[C@@]3([C@@H]1O)[C@@H]2O |
MNX internals
| InChI (mnx) | InChI=1/C20H28O6/c1-9-10-5-6-11-18-8-4-7-17(2,3)12(18)15(23)20(25,26-16(18)24)19(11,13(9)21)14(10)22/h10-15,21-23,25H,1,4-8H2,2-3H3/t10-,11+,12-,13-,14-,15+,18-,19+,20-/m1/s1 |
 |
| SMILES (mnx) | [CH2:1]=[C:9]1[C@H:10]2[CH2:5][CH2:6][C@H:11]3[C@:18]45[CH2:8][CH2:4][CH2:7][C:17]([CH3:2])([CH3:3])[C@H:12]4[C@H:15]([OH:23])[C@:20]([OH:25])([C@@:19]3([C@@H:13]1[OH:21])[C@@H:14]2[OH:22])[O:26][C:16]5=[O:24] |
|