TPCN06137
![[object Object]](../../static/browser_molecular_png/TPCN06137.png)
| Name | Acernikoenoside B |
| Molecular Formula | C54H84O21 |
| Molecular Weight | 1069.25 |
| CAS Registry Number | 2242905-51-5 |
| SMILES | CC=C(C)C(=O)OC1C(OC(C)=O)C2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(OC6OC(CO)C(OC7OCC(O)C(O)C7O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2CC1(C)C |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Sapindaceae | Acer nikoense | Barks | 0.000579% | Chem Pharm Bull (Tokyo) . 2016;64(7):924-9 | 10.1248/cpb.c16-00146 |
Properties
| HBA | 21 | HBD | 10 |
| HeavyAtoms | 75 | AlogP | 1.37 |
| TPSA | 327.35 | RotatableBonds | 12 |
| FractionCSP3 | 0.87 | Rings | 8 |
| AromaticRings | 0 | AliphaticRings | 8 |