3,4-Dihydroxylupanine; (3β,4α)-form
AlkaPlorer ID: AK296267
Synonym: Lebeckianine
IUPAC Name: 4,5-dihydroxy-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecan-6-one
Structure
SMILES: O=C1C(O)C(O)CC2C3CC(CN12)C1CCCCN1C3
InChI: InChI=1S/C15H24N2O3/c18-13-6-12-9-5-10(8-17(12)15(20)14(13)19)11-3-1-2-4-16(11)7-9/h9-14,18-19H,1-8H2
InChIKey: XLHXRPKHKRQZDA-UHFFFAOYSA-N
Reference
Co-occurrence of hydroxylated lupanines and their corresponding angelate esters inPearsonia species
PubChem CID: 14355509
LOTUS: LTS0077924
COCONUT: CNP0200624.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Lebeckia | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Lebeckia | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 280.36799999999994
TPSA？: 64.01
MolLogP？: -0.1866999999999998
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|