TPCN01202

Name Dictamnoside B
Molecular Formula C21H36O9
Molecular Weight 432.51
CAS Registry Number 202278-89-5
SMILES C=C1CCC(O)C2(CO)CCC(C(C)(C)O)C(OC3OC(CO)C(O)C(O)C3O)C12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Rutaceae Dictamnus dasycarpus Barks 0.001350% J Nat Prod 64(7): 935-938.(2001) 10.1021/np000567t
Properties
HBA 9 HBD 7
HeavyAtoms 30 AlogP -1.34
TPSA 160.07 RotatableBonds 5
FractionCSP3 0.90 Rings 3
AromaticRings 0 AliphaticRings 3