TPCN02028

Name Montacephalin
Molecular Formula C20H22O7
Molecular Weight 374.39
CAS Registry Number 115995-12-5
SMILES C=C1C(=O)OC2C1C(O)C(OC(=O)C=C(C)C)C(C)=C1C(=O)C=C(C)C12O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Malvaceae Montanoa tomentosa Leaves 0.000014% J Pharm Sci 77(6): 553-556.(1988) 10.1002/jps.2600770620
Properties
HBA 7 HBD 2
HeavyAtoms 27 AlogP 0.91
TPSA 110.13 RotatableBonds 2
FractionCSP3 0.45 Rings 3
AromaticRings 0 AliphaticRings 3