Molecule

Thalicarpine

AlkaPlorer ID: AK315751

Synonym: Thaliblastine, NSC 68075

IUPAC Name: 9-[2-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]-4,5-dimethoxyphenoxy]-1,2,10-trimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline

Structure

SMILES: COC1=C(OC)C=C(OC2=CC3=C(C=C2OC)C2=C(OC)C(OC)=CC4=C2C(C3)N(C)CC4)C(CC2C3=CC(OC)=C(OC)C=C3CCN2C)=C1

InChI: InChI=1S/C41H48N2O8/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/h16-22,29-30H,10-15H2,1-9H3

InChIKey: ZCTJIMXXSXQXRI-UHFFFAOYSA-N

Reference

Alkaloids of thalictrum—X

PubChem CID: 609931

CAS: 5373-42-2

LOTUS: LTS0193954

COCONUT: CNP0285311.6

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Thalictrum minus	Thalictrum	Ranunculaceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
None	Thalictrum	Ranunculaceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Hernandia nymphaeifolia	Hernandia	Hernandiaceae	Laurales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Thalictrum dasycarpum	Thalictrum	Ranunculaceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Hernandia ovigera	Hernandia	Hernandiaceae	Laurales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
None	Thalictrum	Ranunculaceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
None	Thalictrum	Ranunculaceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 696.8410000000001

TPSA？: 80.32000000000001

MolLogP？: 7.062900000000008

Number of H-Donors: 0

Number of H-Acceptors: 10

RingCount: 7

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi