TPCN03200

Name Spiratine B
Molecular Formula C24H33NO5
Molecular Weight 415.53
CAS Registry Number 334865-87-1
SMILES C=C1CC23CCC1CC2C12C=NC(O)C(C)(CCC1)C2C(OC(C)=O)C3OC(C)=O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Rosaceae Spiraea japonica Roots 0.000026% J Nat Prod 64, 379-380 (2001). 10.1021/np0004911
Properties
HBA 6 HBD 1
HeavyAtoms 30 AlogP 3.42
TPSA 85.19 RotatableBonds 2
FractionCSP3 0.79 Rings 6
AromaticRings 0 AliphaticRings 6