TPCN02199

[object Object]
Name Isotalatizidine (3??;Isotatizidine;Isotalatizidine
Molecular Formula C23H37NO5
Molecular Weight 407.55
CAS Registry Number 7633-68-3
SMILES CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(O)(C(CC23)C14)C5C6O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Aconitum vilmorinianum Roots 0.040000% Planta Med. 57(1991) 10.1055/s-2006-960089
Ranunculaceae Aconitum napellus Aerial parts 0.008014% J Nat Prod 62, 701-704 (1999). 10.1021/np980442c
Ranunculaceae Aconitum anthora Whole plants 0.005455% Planta Med 2011; 77: 368–373 10.1055/s-0030-1250362
Ranunculaceae Aconitum japonicum Subterraneous stems 0.001843% J Nat Med 72, 230-237 (2018). 10.1007/s11418-017-1139-9
Ranunculaceae Aconitum hemsleyanum Roots 0.000380% Nat Prod Res, 1-6 (2019). 10.1080/14786419.2018.1560292
Ranunculaceae Aconitum nagarum Roots 0.000075% Planta Med 2005; 71: 1073±1076 10.1055/s-2005-873135
Properties
HBA 6 HBD 3
HeavyAtoms 29 AlogP 0.88
TPSA 82.39 RotatableBonds 4
FractionCSP3 1.00 Rings 6
AromaticRings 0 AliphaticRings 6