methyl 12-methoxy-N-decarbomethoxychanofruticosinate
AlkaPlorer ID: AK113282
Synonym: None
IUPAC Name: methyl (1R,4S,12R,13S,16R)-7-methoxy-17-oxo-5,14-diazahexacyclo[12.4.3.01,13.04,12.06,11.012,16]henicosa-6(11),7,9-triene-4-carboxylate
Structure
SMILES: COC(=O)[C@]12CC[C@]34CCCN5C[C@H](C(=O)C3)[C@@]1(C1=C(N2)C(OC)=CC=C1)[C@@H]54
InChI: InChI=1S/C22H26N2O4/c1-27-16-6-3-5-13-17(16)23-21(19(26)28-2)9-8-20-7-4-10-24-12-14(15(25)11-20)22(13,21)18(20)24/h3,5-6,14,18,23H,4,7-12H2,1-2H3/t14-,18+,20-,21-,22+/m1/s1
InChIKey: DURZPTVMWVJYBB-TVTJTFRUSA-N
Reference
Kopreasin A, a New Indole Alkaloid from Kopsia arborea
PubChem CID: 163032605
LOTUS: LTS0027001
SuperNatural Ⅲ: SN0075993-01
NPASS: NPC18820
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Robinia pseudoacacia | Robinia | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Lecocarpus pinnatifidus | Lecocarpus | Asteraceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 382.4600000000001
TPSA？: 67.87
MolLogP？: 2.1175
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|