TPCN05220
![[object Object]](../../static/browser_molecular_png/TPCN05220.png)
| Name | (3??,21??)-21-[(??-d-glucopyranosyl-(1??2)-??-d-glucopyranosyl)oxy]-3-hydroxyolean-12-en-28-oic acid |
| Molecular Formula | C42H68O14 |
| Molecular Weight | 796.99 |
| CAS Registry Number | 2084075-59-0 |
| SMILES | CC1(C)CC2C3=CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)CCC2(C(=O)O)CC1OC1OC(CO)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Boraginaceae | Anchusa italica | Whole plants | 0.000036% | Nat Prod Res 31, 959-965 (2017) | 10.1080/14786419.2016.1258557 |
Properties
| HBA | 14 | HBD | 9 |
| HeavyAtoms | 56 | AlogP | 1.85 |
| TPSA | 236.06 | RotatableBonds | 7 |
| FractionCSP3 | 0.93 | Rings | 7 |
| AromaticRings | 0 | AliphaticRings | 7 |