TPCN02177

Name Phyllanthacidoid H
Molecular Formula C39H56O25
Molecular Weight 924.85
CAS Registry Number 1610884-09-7
SMILES CC1COC2(CC1OC(=O)c1ccc(O)cc1)OC1(O)CC(C(=O)OC3CC(O)C(O)C(O)C3OC3OC(CO)C(O)C(O)C3OC3OC(CO)C(O)C(O)C3O)CC(O)C1(O)C2O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Phyllanthaceae Phyllanthus acidus Whole plants 0.000096% Natural Product Research 35, 3540-3547 (2021). 10.1080/14786419.2020.1712387
Properties
HBA 25 HBD 15
HeavyAtoms 64 AlogP -7.34
TPSA 411.43 RotatableBonds 10
FractionCSP3 0.79 Rings 7
AromaticRings 1 AliphaticRings 6