thalicarpine
AlkaPlorer ID: AK010607
Synonym: 'Thalicarpine', 'Taliblastine', '(+)-Thalicarpine', 'TBL'
IUPAC Name: None
Structure
SMILES: COC1=C(OC)C=C(OC2=CC3=C(C=C2OC)C2=C(OC)C(OC)=CC4=C2[C@@H](C3)[NH+](C)CC4)C(C[C@H]2C3=CC(OC)=C(OC)C=C3CC[NH+]2C)=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/p+2/t29-,30+/m0/s1
InChIKey: ZCTJIMXXSXQXRI-XZWHSSHBSA-P
Reference
NPASS: NPC72329
Source
Properties Information
Molecule Weight: 698.8570000000001
TPSA？: 82.72000000000001
MolLogP？: 4.228700000000003
Number of H-Donors: 2
Number of H-Acceptors: 8
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|