Integerrine; N-De-Me
AlkaPlorer ID: AK302597
Synonym: N-Demethylintegerrine
IUPAC Name: None
Structure
SMILES: CNC(C(=O)NC1C(=O)NC(CC2=CNC3=CC=CC=C23)C(=O)NC=CC2=CC=C(C=C2)OC1C1=CC=CC=C1)C(C)C
InChI: InChI=1S/C34H37N5O4/c1-21(2)29(35-3)33(41)39-30-31(23-9-5-4-6-10-23)43-25-15-13-22(14-16-25)17-18-36-32(40)28(38-34(30)42)19-24-20-37-27-12-8-7-11-26(24)27/h4-18,20-21,28-31,35,37H,19H2,1-3H3,(H,36,40)(H,38,42)(H,39,41)
InChIKey: NGIZRGDZQGORFC-UHFFFAOYSA-N
Reference
CAS: 70440-98-1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ceanothus integerrimus | Ceanothus | Rhamnaceae | Rosales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 579.7010000000001
TPSA？: 124.35
MolLogP？: 3.8448000000000047
Number of H-Donors: 5
Number of H-Acceptors: 5
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|