TPCN06068
![[object Object]](../../static/browser_molecular_png/TPCN06068.png)
| Name | 16??,21??,23,28-Tetrahydroxy-22??-O-(2-methylbutanoyl)-15??-O-(3-methylbutanoyl)olean-12-ene 3??-O-??-L-rhamnopyranosyl-(1??3)-??-L-arabinopyranosyl-(1??3)-??-D-glucuronopyranoside |
| Molecular Formula | C57H92O23 |
| Molecular Weight | 1145.34 |
| CAS Registry Number | 2276754-38-0 |
| SMILES | CCC(C)C(=O)OC1C(O)C(C)(C)CC2C3=CCC4C5(C)CCC(OC6OC(C(=O)O)C(O)C(OC7OCC(O)C(OC8OC(C)C(O)C(O)C8O)C7O)C6O)C(C)(CO)C5CCC4(C)C3(C)C(OC(=O)CC(C)C)C(O)C21CO |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Theaceae | Camellia japonica | Roots | 0.001357% | J Nat Prod . 2018 Nov 26;81(11):2399-2409 | 10.1021/acs.jnatprod.8b00374 |
Properties
| HBA | 23 | HBD | 12 |
| HeavyAtoms | 80 | AlogP | 0.42 |
| TPSA | 367.81 | RotatableBonds | 15 |
| FractionCSP3 | 0.91 | Rings | 8 |
| AromaticRings | 0 | AliphaticRings | 8 |