TPCN00167

Name Rauvoyunnanines A;Spegatrine
Molecular Formula C20H25N2O2+
Molecular Weight 325.43
CAS Registry Number 47326-53-4
SMILES CC=C1C[N+]2(C)C3CC1C(CO)C2Cc1c3[nH]c2ccc(O)cc12
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Paeoniaceae Rauvolfia yunnanensis Whole plants 0.001788% Molecules, 2019, 24. 10.3390/molecules24244574
Apocynaceae Rauvolfia verticillata Stems 0.001760% Fitoterapia, 2015, 107, 44-48. 10.1016/j.fitote.2015.10.004
Paeoniaceae Rauvolfia yunnanensis Whole plants 0.000176% Molecules, 2019, 24. 10.3390/molecules24244574
Properties
HBA 4 HBD 3
HeavyAtoms 24 AlogP 2.87
TPSA 56.25 RotatableBonds 1
FractionCSP3 0.50 Rings 6
AromaticRings 2 AliphaticRings 4