(-)-chimonanthine
AlkaPlorer ID: AK005460
Synonym: '', '(+)-Chimonanthine', '(-)-Chimonanthine', 'MLS000728645', 'SMR000470821', 'MLSMR', 'chimonanthine', 'meso-Chimonanthine', 'Chimonanthin', 'Chimonanthine', '1-demethylcalycanthidine'
IUPAC Name: (3aS,8bS)-8b-[(3aS,8bS)-3-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-8b-yl]-3-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indole
Structure
SMILES: CN1CC[C@@]2([C@@]34CCN(C)[C@@H]3NC3=CC=CC=C34)C3=CC=CC=C3N[C@@H]12
InChI: InChI=1S/C22H26N4/c1-25-13-11-21(15-7-3-5-9-17(15)23-19(21)25)22-12-14-26(2)20(22)24-18-10-6-4-8-16(18)22/h3-10,19-20,23-24H,11-14H2,1-2H3/t19-,20-,21+,22+/m0/s1
InChIKey: HOYXPMHLHJOGHD-FNAHDJPLSA-N
Reference
Two new tryptamine-derived alkaloids from Chimonanthus praecox f. concolor
PubChem CID: 3083909
CAS: 5545-89-1
LOTUS: LTS0047745
SuperNatural Ⅲ: SN0131550-04
NPASS: NPC60262
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Pyrola calliantha | Pyrola | Ericaceae | Ericales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Pyrola japonica | Pyrola | Ericaceae | Ericales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Pyrola incarnata | Pyrola | Ericaceae | Ericales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 346.47800000000007
TPSA？: 30.54
MolLogP？: 3.036600000000001
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|