Mesembrenol
AlkaPlorer ID: AK059351
Synonym: '(+)-Mesembrenol'
IUPAC Name: (3aR,6S,7aS)-3a-(3,4-dimethoxyphenyl)-1-methyl-3,6,7,7a-tetrahydro-2H-indol-6-ol
Structure
SMILES: COC1=CC=C([C@@]23C=C[C@@H](O)C[C@@H]2N(C)CC3)C=C1OC
InChI: InChI=1S/C17H23NO3/c1-18-9-8-17(7-6-13(19)11-16(17)18)12-4-5-14(20-2)15(10-12)21-3/h4-7,10,13,16,19H,8-9,11H2,1-3H3/t13-,16+,17+/m1/s1
InChIKey: PQBHZMSTECYZLH-COXVUDFISA-N
Reference
Sceletium alkaloids. IV. Biosynthesis of mesembrine and related alkaloids. Amino acid precursors
PubChem CID: 139262238
LOTUS: LTS0255593
SuperNatural Ⅲ: SN0292158-02
NPASS: NPC36474
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Piper trichostachyon | Piper | Piperaceae | Piperales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Gracilaria asiatica | Gracilaria | Gracilariaceae | Gracilariales | Florideophyceae | Rhodophyta | None | Eukaryota |
| Flavobacterium johnsoniae | Flavobacterium | Flavobacteriaceae | Flavobacteriales | Flavobacteriia | Bacteroidota | None | Bacteria |
Properties Information
Molecule Weight: 289.375
TPSA？: 41.93000000000001
MolLogP？: 1.9665
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|