TPCN02555

Name 7
Molecular Formula C26H42O9
Molecular Weight 498.61
CAS Registry Number 762293-68-5
SMILES CC1(C(O)CO)C=C2CCC3C(C)(C)C(OC4OC(CO)C(O)C(O)C4O)C(=O)CC3(C)C2CC1
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Siegesbeckia orientalis Aerial parts 0.000733% J Nat Prod 67, 1517-1521 (2004). 10.1021/np0400407
Properties
HBA 9 HBD 6
HeavyAtoms 35 AlogP 0.28
TPSA 156.91 RotatableBonds 5
FractionCSP3 0.88 Rings 4
AromaticRings 0 AliphaticRings 4