TPCN04135
Name | Julibroside J35 |
Molecular Formula | C100H158O48 |
Molecular Weight | 2128.32 |
CAS Registry Number | 1309354-85-5 |
SMILES | C=CC(C)(CCC=C(C)C(=O)OC1C(C)OC(OC(C)(C=C)CCC=C(C)C(=O)OC2CC3(C(=O)OC4OC(CO)C(O)C(O)C4OC4OC(C)C(OC5OC(CO)C(O)C5O)C(OC5OC(CO)C(O)C(O)C5O)C4O)C(O)CC4(C)C(=CCC5C6(C)CCC(OC7OC(COC8OCC(O)C(O)C8OC8OCC(O)C(O)C8O)C(O)C(O)C7O)C(C)(C)C6CCC54C)C3CC2(C)C)C(O)C1O)OC1OCC(O)C(O)C1O |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Fabaceae | Albizia julibrissin | Barks | 0.000040% | Fitoterapia 81, 859-863 (2010). | 10.1016/j.fitote.2010.05.014 |
Properties
HBA | 48 | HBD | 25 |
HeavyAtoms | 148 | AlogP | -5.93 |
TPSA | 741.56 | RotatableBonds | 34 |
FractionCSP3 | 0.87 | Rings | 14 |
AromaticRings | 0 | AliphaticRings | 14 |