TPCN00909

Name 3??, 7??-Dibydroxy-5??,6??-epoxyeudesm-4(15)-ene-11-(O-??-fucopyranoside-2', 4'-diangelate-3'-isobutyrate)
Molecular Formula C35H52O11
Molecular Weight 648.79
CAS Registry Number 151625-91-1
SMILES C=C1C(O)CCC2(C)CCC(O)(C(C)(C)OC3OC(C)C(OC(=O)C(C)=CC)C(OC(=O)C(C)C)C3OC(=O)C(C)=CC)C3OC132
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Calendula arvensis Aerial parts 0.011250% J Nat Prod 56, 1821-1824(1993) 10.1021/np50100a025
Properties
HBA 11 HBD 2
HeavyAtoms 46 AlogP 4.23
TPSA 150.35 RotatableBonds 9
FractionCSP3 0.74 Rings 4
AromaticRings 0 AliphaticRings 4