TPCN00944

Name Crystallinin
Molecular Formula C15H22NaO5
Molecular Weight 305.33
CAS Registry Number 1235713-10-6
SMILES CC(C)C1C2OC(=O)C1C1C(O)C=C(CO)C1(C)C2O.[Na]
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Orchidaceae Dendrobium findlayanum Whole plants 0.008523% J Asian Nat Prod Res 13(11): 1047-1050.(2011) 10.1080/10286020.2011.620952
Properties
HBA 5 HBD 3
HeavyAtoms 21 AlogP -0.29
TPSA 86.99 RotatableBonds 2
FractionCSP3 0.80 Rings 3
AromaticRings 0 AliphaticRings 3