3-(4-Hydroxybenzyl)-6-isopropyl-2,5-piperazinedione; (3R,6S)-form
AlkaPlorer ID: AK300945
Synonym: L-L-form
IUPAC Name: 3-[(4-hydroxyphenyl)methyl]-6-propan-2-ylpiperazine-2,5-dione
Structure
SMILES: CC(C)C1N=C(O)C(CC2=CC=C(O)C=C2)N=C1O
InChI: InChI=1S/C14H18N2O3/c1-8(2)12-14(19)15-11(13(18)16-12)7-9-3-5-10(17)6-4-9/h3-6,8,11-12,17H,7H2,1-2H3,(H,15,19)(H,16,18)
InChIKey: LMDVFSHGYANGRP-UHFFFAOYSA-N
Reference
Minor constituents from the tubers of<i>Gymnadenia conopsea</i>
PubChem CID: 44197922
LOTUS: LTS0232981
COCONUT: CNP0174075.2
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Gymnadenia conopsea | Gymnadenia | Orchidaceae | Asparagales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 262.309
TPSA？: 85.41000000000001
MolLogP？: 2.2545
Number of H-Donors: 3
Number of H-Acceptors: 3
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|