TPCN00627
![[object Object]](../../static/browser_molecular_png/TPCN00627.png)
| Name | 3,7-dimethyl-2(E),6-octadien-5-one-1-O-_x0002_-D-6-Oacetylglucopyranoside |
| Molecular Formula | C18H28O8 |
| Molecular Weight | 372.41 |
| CAS Registry Number | 1160611-64-2 |
| SMILES | CC(=O)OCC1OC(OCC=C(C)CC(=O)C=C(C)C)C(O)C(O)C1O |
| Classify | Monoterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Fabaceae | Indigofera heterantha | Whole plants | 0.000084% | Nat Prod Res, 2008, 22, 1189-1195. | 10.1080/14786410801980097 |
Properties
| HBA | 8 | HBD | 3 |
| HeavyAtoms | 26 | AlogP | 0.25 |
| TPSA | 122.52 | RotatableBonds | 8 |
| FractionCSP3 | 0.67 | Rings | 1 |
| AromaticRings | 0 | AliphaticRings | 1 |