TPCN00455
![[object Object]](../../static/browser_molecular_png/TPCN00455.png)
| Name | Paeoniside B |
| Molecular Formula | C30H32O15 |
| Molecular Weight | 632.57 |
| CAS Registry Number | 1505511-19-2 |
| SMILES | CC12CC3(O)OC(O1)C1(COC(=O)c4ccccc4)C3CC21OC1OC(COC(=O)c2cc(O)c(O)c(O)c2)C(O)C(O)C1O |
| Classify | Monoterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Paeoniaceae | Paeonia suffruticosa | Roots | 0.000260% | Nat Prod Res, 2014, 28, 301-305. | 10.1080/14786419.2013.858340 |
Properties
| HBA | 15 | HBD | 7 |
| HeavyAtoms | 45 | AlogP | -0.38 |
| TPSA | 231.13 | RotatableBonds | 8 |
| FractionCSP3 | 0.53 | Rings | 9 |
| AromaticRings | 2 | AliphaticRings | 7 |