Cherylline

AlkaPlorer ID: AK001354

Synonym: 'Cheryllin', '(S)-(-)-Cherylline', 'Cherylline', 'Crinine', '(-)-Cherylline', 'Crinine(C17 alkaloid)'

IUPAC Name: (4S)-4-(4-hydroxyphenyl)-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol

Structure

SMILES: COC1=CC2=C(C=C1O)CN(C)C[C@H]2C1=CC=C(O)C=C1

copy

InChI: InChI=1S/C17H19NO3/c1-18-9-12-7-16(20)17(21-2)8-14(12)15(10-18)11-3-5-13(19)6-4-11/h3-8,15,19-20H,9-10H2,1-2H3/t15-/m0/s1

copy

InChIKey: VXXVFIKKBBVGIR-HNNXBMFYSA-N

copy

Reference

Alkaloids from Crinum lugardiae

PubChem CID: 90075

CAS: 23367-61-5

LOTUS: LTS0026954

SuperNatural Ⅲ: SN0403068-01

Source

Properties Information

Molecule Weight: 285.343

TPSA: 52.93000000000001

MolLogP: 2.683700000000001

Number of H-Donors: 2

Number of H-Acceptors: 4

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information