TPCN06028
Name | Grandibracteoside A |
Molecular Formula | C73H112N2O32 |
Molecular Weight | 1529.68 |
CAS Registry Number | 860021-37-0 |
SMILES | CC(=O)NC1C(OC2CCC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)C(OC(=O)c6ccccc6N)CC5(C(=O)OC5OC(CO)C(O)C(O)C5OC5OC(C)C(OC6OCC(O)C(O)C6O)C(O)C5O)C(O)CC34C)C2(C)C)OC(COC2OC(C)C(O)C(O)C2OC2OCC(O)C(O)C2O)C(O)C1O |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Fabaceae | Albizia grandibracteata | Leaves | 0.002500% | J Nat Prod . 2005 Jun;68(6):897-903 | 10.1021/np049576i |
Properties
HBA | 34 | HBD | 19 |
HeavyAtoms | 107 | AlogP | -3.52 |
TPSA | 532.93 | RotatableBonds | 17 |
FractionCSP3 | 0.85 | Rings | 12 |
AromaticRings | 1 | AliphaticRings | 11 |