Cocsulinine; O12-Me, N2'-de-Me
AlkaPlorer ID: AK292758
Synonym: Gilletine, Alkaloid TGL4
IUPAC Name: 9,20-dimethoxy-15-methyl-7,23,33-trioxa-15,30-diazaoctacyclo[19.9.3.23,6.18,12.114,18.024,32.027,31.022,34]heptatriaconta-3(37),4,6(36),8,10,12(35),18,20,22(34),24,26,31-dodecaen-25-ol
Structure
SMILES: COC1=CC=C2C=C1OC1=CC=C(C=C1)CC1NCCC3=C1C1=C(OC4=C5C(=CC(OC)=C4O1)CCN(C)C5C2)C(O)=C3
InChI: InChI=1S/C35H34N2O6/c1-37-13-11-22-18-29(40-3)33-35-31(22)25(37)15-20-6-9-27(39-2)28(16-20)41-23-7-4-19(5-8-23)14-24-30-21(10-12-36-24)17-26(38)32(42-35)34(30)43-33/h4-9,16-18,24-25,36,38H,10-15H2,1-3H3
InChIKey: BSMKSTAEJFRBHA-UHFFFAOYSA-N
Reference
Gilletine, a New Bisbenzylisoquinoline Alkaloid from Triclisia gilletii
PubChem CID: 99954
CAS: 52038-20-7
LOTUS: LTS0260864
COCONUT: CNP0203361.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Triclisia | Menispermaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Triclisia | Menispermaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 578.6650000000004
TPSA？: 81.65
MolLogP？: 6.614300000000006
Number of H-Donors: 2
Number of H-Acceptors: 8
RingCount: 10
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|