Cannabisin E; 7'-Deoxy, 7',8'-didehydro(Z-)
AlkaPlorer ID: AK291545
Synonym: Cannabisin F
IUPAC Name: (Z)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]-2-[4-[(E)-3-[2-(4-hydroxyphenyl)ethylamino]-3-oxoprop-1-enyl]-2-methoxyphenoxy]prop-2-enamide
Structure
SMILES: COC1=CC(/C=C(\OC2=CC=C(/C=C/C(O)=NCCC3=CC=C(O)C=C3)C=C2OC)C(O)=NCCC2=CC=C(O)C=C2)=CC=C1O
InChI: InChI=1S/C36H36N2O8/c1-44-32-22-27(7-14-30(32)41)23-34(36(43)38-20-18-25-5-12-29(40)13-6-25)46-31-15-8-26(21-33(31)45-2)9-16-35(42)37-19-17-24-3-10-28(39)11-4-24/h3-16,21-23,39-41H,17-20H2,1-2H3,(H,37,42)(H,38,43)/b16-9+,34-23-
InChIKey: JCUQMHMUDDMCSX-AADBSILNSA-N
Reference
Three acyclic bis-phenylpropane lignanamides from fruits of Cannabis sativa
PubChem CID: 71448967
CAS: 163136-19-4
LOTUS: LTS0153935
SuperNatural Ⅲ: SN0162000-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Mitrephora | Annonaceae | Magnoliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Alocasia cucullata | Alocasia | Araceae | Alismatales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Cannabis sativa | Cannabis | Cannabaceae | Rosales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 624.6900000000004
TPSA？: 153.56
MolLogP？: 6.652100000000008
Number of H-Donors: 5
Number of H-Acceptors: 8
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|