| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2008 | 13 | Yes |
Popular Name: D-PINITOL D-PINITOL
Find On: PubMed — Wikipedia — Google
CAS Numbers: 10284-63-6 , 484-68-4 , 523-92-2 , [10284-63-6] , [6090-97-7]
(1R,2S,3S,4S,5S,6S)-6-methoxycyclohexane-1,2,3,4,5-pentol; 1D-4-O-methyl-myo-inositol
10284-63-6; 1D-3-O-Methyl-chiro-inositol; 5D-5-O-Methyl-chiro-inositol; C03844; D-Pinitol
1D-4-O-Methyl-myo-inositol; 4-O-Methyl-myo-inositol; C06352
1D-4-O-methyl-myo-inositol; 4-O-methyl-myo-inositol; CPD-13141; ononitol
1D-4-O-Methyl-myo-inositol;D-Ononitol;Ononitol
3-O-methyl-D-chiro-inositol; 6-methoxycyclohexane-1,2,3,4,5-pentaol; CPD-8046; D-pinitol; inzitol
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | -1.99 | -8.45 | -9.94 | 5 | 6 | 0 | 110 | 194.183 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 178-185? | Alfa-Aesar |
| Melting_Point | 178-185° | Alfa-Aesar |
| Target | Cyclin-dependent kinase inhibitor 1(P38936)&Eukaryotic translation initiation factor 6(P56537) | Herbal Ingredients Targets |
| UniProt Database Links | IMT1_MESCR | ChEBI |
