UNPD60491
AlkaPlorer ID: AK357000
Synonym: None
IUPAC Name: (1R,4Z,7S,17R)-4-ethylidene-7-hydroxy-7-methyl-6-methylidene-14-oxido-2,9-dioxa-14-azoniatricyclo[9.5.1.014,17]heptadec-11-ene-3,8-dione
Structure
SMILES: C=C1C/C(=C/C)C(=O)O[C@@H]2CC[N+]3([O-])CC=C(COC(=O)[C@@]1(C)O)[C@H]23
InChI: InChI=1S/C18H23NO6/c1-4-12-9-11(2)18(3,22)17(21)24-10-13-5-7-19(23)8-6-14(15(13)19)25-16(12)20/h4-5,14-15,22H,2,6-10H2,1,3H3/b12-4-/t14-,15-,18+,19?/m1/s1
InChIKey: COHUFMBRBUPZPA-WAUJYEHCSA-N
Reference
THE ALKALOIDS OF <i>SENECIO</i> SPECIES: IV. <i>ERECHTITES HIERACIFOLIA</i> (L.) RAF.
PubChem CID: 163185004
LOTUS: LTS0087192
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Senecio rosmarinifolius | Senecio | Asteraceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 349.38300000000004
TPSA？: 95.89
MolLogP？: 1.1254999999999995
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|