TPCN02321

Name 5
Molecular Formula C26H42O8
Molecular Weight 482.61
CAS Registry Number 762293-65-2
SMILES CC1(C)CC(=O)CC2(C)C3CCC(C)(C(O)COC4OC(CO)C(O)C(O)C4O)C=C3CCC12
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Siegesbeckia orientalis Aerial parts 0.002667% J Nat Prod 67, 1517-1521 (2004). 10.1021/np0400407
Properties
HBA 8 HBD 5
HeavyAtoms 34 AlogP 1.31
TPSA 136.68 RotatableBonds 5
FractionCSP3 0.88 Rings 4
AromaticRings 0 AliphaticRings 4