TPCN01775

Name Chlorahololide D
Molecular Formula C38H44O11
Molecular Weight 676.76
CAS Registry Number 943136-39-8
SMILES CC=C(C)C(=O)OCC1(O)C2CC2C2(C)C1CC1=C(COC(C)=O)C(=O)OC13C1C(=C(C)C(=O)OC)C(=O)C(O)C4(C)C1=C(CC32)C1CC14
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Chloranthaceae Chloranthus serratus Roots 0.000125% J Nat Prod 82, 407-411.(2019) 10.1021/acs.jnatprod.8b00418
Properties
HBA 11 HBD 2
HeavyAtoms 49 AlogP 3.08
TPSA 162.73 RotatableBonds 6
FractionCSP3 0.66 Rings 8
AromaticRings 0 AliphaticRings 8