TPCN01874

Name Chloramultiols C
Molecular Formula C36H42O11
Molecular Weight 650.72
CAS Registry Number 1221236-52-7
SMILES CC=C(C)C(=O)OCC1(O)C2CC2C2(C)C3CC4(O)C5=C(C6=C(C)C(=O)OC6(OC)C(O)C5(C)C5CC54)C34OC(=O)C(CO)=C4CC12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Chloranthaceae Chloranthus multistachys Whole plants 0.000068% J Nat Prod 73(5): 972-975.(2010) 10.1021/np900764n
Properties
HBA 11 HBD 4
HeavyAtoms 47 AlogP 1.78
TPSA 169.05 RotatableBonds 5
FractionCSP3 0.69 Rings 9
AromaticRings 0 AliphaticRings 9