Supinidine; (S)-form, O-[2S-Hydroxy-2-(1S-hydroxyethyl)-4-methylpentanoyl], N-oxide
AlkaPlorer ID: AK314731
Synonym: None
IUPAC Name: None
Structure
SMILES: CC(C)CC(O)(C(=O)OCC1=CC[N+]2([O-])CCCC12)C(C)O
InChI: InChI=1S/C16H27NO5/c1-11(2)9-16(20,12(3)18)15(19)22-10-13-6-8-17(21)7-4-5-14(13)17/h6,11-12,14,18,20H,4-5,7-10H2,1-3H3
InChIKey: NSKPWPHUVJTSRD-UHFFFAOYSA-N
Reference
CAS: 701976-73-0
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Anchusa strigosa | Anchusa | Boraginaceae | Boraginales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 313.39399999999995
TPSA？: 89.82000000000001
MolLogP？: 1.1046000000000002
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|