TPCN02802

Name Scutebarbatine G
Molecular Formula C26H33NO7
Molecular Weight 471.55
CAS Registry Number 960302-86-7
SMILES CC1=CCCC2C1(C)C(O)C(O)C1(C)OC3(COC(=O)C3)CC(OC(=O)c3cccnc3)C21C
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Araliaceae Scutellaria barbata Whole plants 0.000253% Chem Pharm Bull (Tokyo) 55, 1218-1221 (2007). 10.1248/cpb.55.1218
Properties
HBA 8 HBD 2
HeavyAtoms 34 AlogP 2.58
TPSA 115.18 RotatableBonds 2
FractionCSP3 0.65 Rings 5
AromaticRings 1 AliphaticRings 4