TPCN04619

Name Ulmicin B
Molecular Formula C37H54O5
Molecular Weight 578.83
CAS Registry Number 336621-23-9
SMILES C=C(C)C1CCC2(C)CC(O)C3(C)C(CC(OC(=O)c4ccc(O)cc4)C4C5(C)CCC(O)C(C)(C)C5CCC43C)C12
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Ulmaceae Ulmus davidiana Whole plants 0.000180% J Nat Prod 64(3): 328-331. 10.1021/np0004799
Properties
HBA 5 HBD 3
HeavyAtoms 42 AlogP 7.54
TPSA 86.99 RotatableBonds 3
FractionCSP3 0.76 Rings 6
AromaticRings 1 AliphaticRings 5