TPCN03173

Name Tanguticulina D
Molecular Formula C27H31NO8S
Molecular Weight 529.61
CAS Registry Number 2353515-77-0
SMILES C=C1CC23CC4C5C6(C)CC(OC(=O)c7ccccc7)CC57C(C2C(O)C1C(OS(=O)(=O)O)C37)N4C6O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Aconitum tanguticum Whole plants 0.000036% Phytochemistry 160, 71-77 (2019). 10.1016/j.phytochem.2018.11.008
Properties
HBA 9 HBD 3
HeavyAtoms 37 AlogP 1.77
TPSA 133.60 RotatableBonds 4
FractionCSP3 0.67 Rings 10
AromaticRings 1 AliphaticRings 9