bulbisine Trifluoroacetic acid
AlkaPlorer ID: AK051792
Synonym: 'Deacetylbowdensine', 'Di-O-deacetylbowdensine', '1-Epideacetylbowdensine Trifluoroacetic acid', 'Crinan-1,2-diol, 7-methoxy-, (1beta,2beta)-Trifluoroacetic acid'
IUPAC Name: (1S,13S,16S,17R)-9-methoxy-5,7-dioxa-12-azapentacyclo[10.5.2.01,13.02,10.04,8]nonadeca-2,4(8),9-triene-16,17-diol
Structure
SMILES: COC1=C2CN3CC[C@]4(C2=CC2=C1OCO2)[C@@H]3CC[C@H](O)[C@@H]4O
InChI: InChI=1S/C17H21NO5/c1-21-14-9-7-18-5-4-17(13(18)3-2-11(19)16(17)20)10(9)6-12-15(14)23-8-22-12/h6,11,13,16,19-20H,2-5,7-8H2,1H3/t11-,13-,16-,17-/m0/s1
InChIKey: YDHBKYCFICHVSW-SCTFDZSOSA-N
Reference
Alkaloids from Brunsvigia orientalis
PubChem CID: 162893619
LOTUS: LTS0027597
SuperNatural Ⅲ: SN0447228-03
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Brunsvigia orientalis | Brunsvigia | Amaryllidaceae | Asparagales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 319.357
TPSA？: 71.39
MolLogP？: 0.7651999999999999
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|