TPCN02775

Name Sachaconite
Molecular Formula C23H37NO4
Molecular Weight 391.55
CAS Registry Number 1361-02-0
SMILES CCN1CC2(C)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Aconitum hemsleyanum Roots 0.000280% Nat Prod Res, 1-6 (2019). 10.1080/14786419.2018.1560292
Properties
HBA 5 HBD 2
HeavyAtoms 28 AlogP 1.90
TPSA 62.16 RotatableBonds 3
FractionCSP3 1.00 Rings 6
AromaticRings 0 AliphaticRings 6