TPCN02742

Name Delphigraciline
Molecular Formula C40H41NO11
Molecular Weight 711.76
CAS Registry Number 1015757-95-5
SMILES C=C1CC23CC4C5C6(C)CN4C4C5(C(OC(C)=O)C(OC(=O)c5ccccc5)C6OC(C)=O)C2C(OC(C)=O)C1C(OC(=O)c1ccccc1)C43O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Delphinium gracile Aerial parts 0.000316% Nat Prod Res 21, 1048-1055 (2007). 10.1080/14786410701536437
Properties
HBA 12 HBD 1
HeavyAtoms 52 AlogP 3.26
TPSA 154.97 RotatableBonds 7
FractionCSP3 0.53 Rings 11
AromaticRings 2 AliphaticRings 9