TPCN02085

Name 5-hydroxytomencephalin
Molecular Formula C20H24O7
Molecular Weight 376.41
CAS Registry Number 115995-14-7
SMILES C=C1C(=O)OC2C1C(O)C(OC(=O)C=C(C)C)C(C)=C1CC3OC3(C)C12O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Montanoa tomentosa Leaves 0.000003% J Pharm Sci 77(6): 553-556.(1988) 10.1002/jps.2600770620
Properties
HBA 7 HBD 2
HeavyAtoms 27 AlogP 0.95
TPSA 105.59 RotatableBonds 2
FractionCSP3 0.60 Rings 4
AromaticRings 0 AliphaticRings 4