4a-dehydroxycrinamabine Trifluoroacetic acid
AlkaPlorer ID: AK022737
Synonym: '', '4a-Dehydroxycrinamabine', '(1beta,2beta)-Crinan-1,2-diol Trifluoroacetic acid'
IUPAC Name: (1S,13S,16R,17S)-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: O[C@@H]1CC[C@@H]2N3CC[C@@]2(C2=CC4=C(C=C2C3)OCO4)[C@@H]1O
InChI: InChI=1S/C16H19NO4/c18-11-1-2-14-16(15(11)19)3-4-17(14)7-9-5-12-13(6-10(9)16)21-8-20-12/h5-6,11,14-15,18-19H,1-4,7-8H2/t11-,14+,15-,16+/m1/s1
InChIKey: DLYIURZCCWSUKD-CAPXZKIUSA-N
Reference
Alkaloids from<i>Crinum stuhlmannii</i>
PubChem CID: 163084523
LOTUS: LTS0200852
SuperNatural Ⅲ: SN0069285-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Crinum stuhlmannii | Crinum | Amaryllidaceae | Asparagales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 289.331
TPSA？: 62.16000000000001
MolLogP？: 0.7565999999999999
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|