TPCN02246

Name 7-0-METHYLHORMINONE
Molecular Formula C21H30O4
Molecular Weight 346.47
CAS Registry Number 122482-10-4
SMILES COC1CC2C(C)(C)CCCC2(C)C2=C1C(=O)C(C(C)C)=C(O)C2=O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Lepechinia bullata Aerial parts 0.005000% J Nat Prod 52, 571-575 (1989). 10.1021/np50063a016
Properties
HBA 4 HBD 1
HeavyAtoms 25 AlogP 4.15
TPSA 63.60 RotatableBonds 2
FractionCSP3 0.71 Rings 3
AromaticRings 0 AliphaticRings 3