TPCN02240
![[object Object]](../../static/browser_molecular_png/TPCN02240.png)
| Name | 12-alpha-[(2-O-beta-d-glucopyranosyl-beta-d-glucopyranosyl)oxy]ent-kaur-16-en-19- oic acid beta-d-glucopyranosyl ester |
| Molecular Formula | C38H60O18 |
| Molecular Weight | 804.88 |
| CAS Registry Number | 1594138-18-7 |
| SMILES | C=C1CC23CCC4C(C)(C(=O)OC5OC(CO)C(O)C(O)C5O)CCCC4(C)C2CC(OC2OC(CO)C(O)C(O)C2OC2OC(CO)C(O)C(O)C2O)C1C3 |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Stevia rebaudiana | Leaves | 0.005467% | J Nat Prod 77, 1231-1235 (2014). | 10.1021/np4009656 |
Properties
| HBA | 18 | HBD | 11 |
| HeavyAtoms | 56 | AlogP | -3.08 |
| TPSA | 294.98 | RotatableBonds | 9 |
| FractionCSP3 | 0.92 | Rings | 7 |
| AromaticRings | 0 | AliphaticRings | 7 |