Egonine
AlkaPlorer ID: AK079289
Synonym: '', 'Tazettadiol'
IUPAC Name: (3S,3aS,6S,7aS)-3a-[6-(hydroxymethyl)-1,3-benzodioxol-5-yl]-6-methoxy-1-methyl-3,6,7,7a-tetrahydro-2H-indol-3-ol
Structure
SMILES: CO[C@@H]1C=C[C@@]2(C3=CC4=C(C=C3CO)OCO4)[C@H](O)CN(C)[C@H]2C1
InChI: InChI=1S/C18H23NO5/c1-19-8-17(21)18(4-3-12(22-2)6-16(18)19)13-7-15-14(23-10-24-15)5-11(13)9-20/h3-5,7,12,16-17,20-21H,6,8-10H2,1-2H3/t12-,16+,17-,18+/m1/s1
InChIKey: XEEPVFFWNATEGX-IUHNQTRMSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Hippeastrum puniceum | Hippeastrum | Amaryllidaceae | Asparagales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 333.38400000000007
TPSA？: 71.39
MolLogP？: 0.7951999999999998
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|