Dehydrothalicarpine
AlkaPlorer ID: AK294717
Synonym: Thalictrucarpine
IUPAC Name: 5-[2-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]-4,5-dimethoxyphenoxy]-4,15,16-trimethoxy-10-methyl-10-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,3,5,7,9(17),13,15-heptaene
Structure
SMILES: COC1=C(OC)C=C(OC2=CC3=CC4=C5C(=CC(OC)=C(OC)C5=C3C=C2OC)CCN4C)C(CC2C3=CC(OC)=C(OC)C=C3CCN2C)=C1
InChI: InChI=1S/C41H46N2O8/c1-42-12-10-23-16-32(44-3)34(46-5)20-27(23)29(42)15-26-19-33(45-4)36(48-7)22-31(26)51-37-18-25-14-30-39-24(11-13-43(30)2)17-38(49-8)41(50-9)40(39)28(25)21-35(37)47-6/h14,16-22,29H,10-13,15H2,1-9H3
InChIKey: ZZIXUROSFYZXOH-UHFFFAOYSA-N
Reference
Alkaloid-Bearing Plants and Their Contained Alkaloids. 1957-1968
PubChem CID: 418714
CAS: 7224-94-4
LOTUS: LTS0160751
COCONUT: CNP0169597.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Thalictrum dasycarpum | Thalictrum | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Hernandia ovigera | Hernandia | Hernandiaceae | Laurales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 694.825
TPSA？: 80.32000000000001
MolLogP？: 7.60950000000001
Number of H-Donors: 0
Number of H-Acceptors: 10
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|