| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 16 | Yes |
Popular Name: alpha-Bisabolol alpha-Bisabolol
Find On: PubMed — Wikipedia — Google
CAS Numbers: 23178-88-3 , 515-69-5 , [25428-43-7] , [515-69-5]
(2R)-6-Methyl-2-[(1R)-4-methyl-3-cyclohexen-1-yl]-5-hepten-2-ol
(R)-6-Methyl-2-((R)-4-methyl-cyclohex-3-enyl)-hept-5-en-2-ol
(R*,R*)-(±)-,4-Dimethyl-(4-methyl-3-pentenyl)cyclohex-3-ene-1-methanol
| 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) | 4.68 | 0.8 | -1.9 | 1 | 1 | 0 | 20 | 222.372 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| biological_source | Isol. from essential oil of Matricaria chamomilla (chamomile oil). Also from Vanillosmopsis erythropappa | ZereneX Building Blocks |
| biological_use | Anti-inflammator | IBScreen Bioactives |
| biological_use | Anti-irritant | IBScreen Bioactives IBScreen Bioactives |
| biological_use | Anti-microbial | IBScreen Bioactives |
