1-{5-[(3,3-dimethyloxiran-2-yl)methyl]-1H-indol-3-yl}-3-methylbutane-2,3-diol
AlkaPlorer ID: AK111689
Synonym: None
IUPAC Name: (2R)-1-[5-[[(2S)-3,3-dimethyloxiran-2-yl]methyl]-1H-indol-3-yl]-3-methylbutane-2,3-diol
Structure
SMILES: CC(C)(O)[C@H](O)CC1=CNC2=CC=C(C[C@@H]3OC3(C)C)C=C12
InChI: InChI=1S/C18H25NO3/c1-17(2,21)15(20)9-12-10-19-14-6-5-11(7-13(12)14)8-16-18(3,4)22-16/h5-7,10,15-16,19-21H,8-9H2,1-4H3/t15-,16+/m1/s1
InChIKey: HXYYXPJRHVMUQY-CVEARBPZSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Hexalobus crispiflorus | Hexalobus | Annonaceae | Magnoliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 303.40200000000004
TPSA？: 68.78
MolLogP？: 2.562100000000001
Number of H-Donors: 3
Number of H-Acceptors: 3
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|