TPCN03877
![[object Object]](../../static/browser_molecular_png/TPCN03877.png)
| Name | Chikusetsusaponin LM6 |
| Molecular Formula | C58H98O27 |
| Molecular Weight | 1227.40 |
| CAS Registry Number | 87733-68-4 |
| SMILES | CC(C)=CCCC(C)(OC1OC(COC2OCC(OC3OCC(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O)C1CCC2(C)C1C(O)CC1C3(C)CCC(OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4O)C(C)(C)C3C(O)CC12C |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Aquifoliaceae | Ilex litseaefolia | Stems | 0.000415% | J Nat Prod 68, 1531-1535 (2005). | 10.1021/np050285z |
Properties
| HBA | 27 | HBD | 17 |
| HeavyAtoms | 85 | AlogP | -4.13 |
| TPSA | 436.21 | RotatableBonds | 17 |
| FractionCSP3 | 0.97 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |