2-(hydroxymethyl)-6-({3-[2-(methylamino)ethyl]-1H-indol-5-yl}oxy)oxane-3,4,5-triol
AlkaPlorer ID: AK254123
Synonym: None
IUPAC Name: (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[[3-[2-(methylamino)ethyl]-1H-indol-5-yl]oxy]oxane-3,4,5-triol
Structure
SMILES: CNCCC1=CNC2=CC=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C=C12
InChI: InChI=1S/C17H24N2O6/c1-18-5-4-9-7-19-12-3-2-10(6-11(9)12)24-17-16(23)15(22)14(21)13(8-20)25-17/h2-3,6-7,13-23H,4-5,8H2,1H3/t13-,14-,15+,16-,17-/m1/s1
InChIKey: UXTWWETVBITNLA-NQNKBUKLSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Zanthoxylum piperitum | Zanthoxylum | Rutaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 352.387
TPSA？: 127.20000000000002
MolLogP？: -0.8914999999999995
Number of H-Donors: 6
Number of H-Acceptors: 7
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|