12,20-dimethoxy-4-methyl-11,16,18-trioxa-4-azapentacyclo[11.7.0.0²,¹?.0³,?.0¹?,¹?]icosa-1(13),7,14,19-tetraen-9-ol
AlkaPlorer ID: AK254678
Synonym: None
IUPAC Name: (2S,3S,9S,10S,12S)-12,20-dimethoxy-4-methyl-11,16,18-trioxa-4-azapentacyclo[11.7.0.02,10.03,7.015,19]icosa-1(20),7,13,15(19)-tetraen-9-ol
Structure
SMILES: COC1=C2C(=CC3=C1OCO3)[C@@H](OC)O[C@H]1[C@@H]2[C@H]2C(=C[C@@H]1O)CCN2C
InChI: InChI=1S/C19H23NO6/c1-20-5-4-9-6-11(21)16-14(15(9)20)13-10(19(23-3)26-16)7-12-17(18(13)22-2)25-8-24-12/h6-7,11,14-16,19,21H,4-5,8H2,1-3H3/t11-,14-,15+,16+,19-/m0/s1
InChIKey: KHGRVWYCPNVQPH-MXZRBDGUSA-N
Reference
6-<i>O</i>-Methylkrigeine, a new Amaryllidaceae alkaloid from<i>Nerine huttoniae</i>Schönland
PubChem CID: 163004522
LOTUS: LTS0217771
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Nerine huttoniae | Nerine | Amaryllidaceae | Asparagales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 361.3940000000001
TPSA?: 69.62
MolLogP?: 1.5562999999999998
Number of H-Donors: 1
Number of H-Acceptors: 7
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|
