TPCN00007

Name Kodemariosides C
Molecular Formula C25H30O11
Molecular Weight 506.50
CAS Registry Number 1222561-28-5
SMILES CC(C)=CC1OC(=O)C(=CCOC2OC(COC(=O)C=Cc3ccc(O)cc3)C(O)C(O)C2O)C1O
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Rosaceae Spiraea cantoniensis Flowers 0.261538% J Nat Prod, 2010, 73, 814-817. 10.1021/np900699e
Properties
HBA 11 HBD 5
HeavyAtoms 36 AlogP -0.05
TPSA 172.21 RotatableBonds 8
FractionCSP3 0.44 Rings 3
AromaticRings 1 AliphaticRings 2