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Every herb, ingredient, formula, gene target, and disease — connected through real research. Search, pick a subject, and navigate the graph in any direction.
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Herb
6,826
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⚗️
Ingredient
44,595
→
🧬
Gene Target
15,505
→
🏥
Disease
30,170
→
🧪
Evidence
23,295
trials · metas · refs
Plus 6,743 TCM formulas connecting herbs together
⚗️ Ingredient
Acetylcholine
1
Clinical Trials
3
Meta-Analyses
0
PubMed References
Top Conditions Studied with Acetylcholine
📋 Sample Trials
NCT00259701
Microvascular Reactivity.
Completed
📊 Sample Meta-Analyses
CRD42022111145
Safety and Diagnostic Utility of Intracoronary Acetylcholine Vasoreactivity Testing
Acetylcholine vasoreactivity testing for vasomotor angina
CRD42021245939
Role of alpha7 nicotinic acetylcholine receptor subunit on modulation of energy homeostasis in peripheral tissues: a systematic review
CRD42021289721
Use of intracoronary acetylcholine in cardiac catheterization laboratories
The use of acetylcholine in Italy for medical purposes is limited to the treatme
📚 Sample References
None linked yet.
⚗️ All Ingredient data fields for Acetylcholine
⚗️ Identity
Name
Acetylcholine
Aliases / Synonyms
Choline acetate; O-Acetylcholine; 51-84-3; (2-Acetoxyethyl)trimethylammonium; Acetyl choline ion; Acetylcholinum; Choline acetate (ester); Acetyl choline cation; 2-(Acetyloxy)-N,N,N-trimethylethanaminium
🧪 Chemistry
Molecular Weight
146.2100
LogP
0.2557
Drug-likeness
0.421
Oral Bioavailability
27.7990
H-Bond Acceptors
2
Rotatable Bonds
3
🔬 Structures
Canonical SMILES
CC(=O)OCC[N+](C)(C)C
Isomeric SMILES
CC(=O)OCC[N+](C)(C)C
InChIKey
OIPILFWXSMYKGL-UHFFFAOYSA-N
InChI
InChI=1S/C7H16NO2/c1-7(9)10-6-5-8(2,3)4/h5-6H2,1-4H3/q+1
🔗 External References
HERB DB
PubChem CID
CAS Number
NPASS
NPC1591
HIT
C0854
SymMap
692
TCMID
351
TCMSP
MOL007355
🔍 Raw view — every non-empty column on this row (33 fields)
name
Acetylcholine
common names
Choline acetate; O-Acetylcholine; 51-84-3; (2-Acetoxyethyl)trimethylammonium; Acetyl choline ion; Acetylcholinum; Choline acetate (ester); Acetyl choline cation; 2-(Acetyloxy)-N,N,N-trimethylethanaminium
herb ingredient id
HBIN014467
canonical smiles
CC(=O)OCC[N+](C)(C)C
isomeric smiles
CC(=O)OCC[N+](C)(C)C
inchi
InChI=1S/C7H16NO2/c1-7(9)10-6-5-8(2,3)4/h5-6H2,1-4H3/q+1
inchikey
OIPILFWXSMYKGL-UHFFFAOYSA-N
mol wt
146.2100
num h acceptors
2
num h donors
0
mol logp
0.2557
num rotatable bonds
3
drug likeness
0.421
ob score
27.7990
cas id
51-84-3
symmap mol id
692
tcmid ingredient id
351
tcmsp ingredient id
MOL007355
pubchem cid
187
npass id
NPC1591
hit id
C0854
📋 Clinical Trials
1 · subject of clinical studyNCT00259701 Microvascular Reactivity.
→ Diabetes|Retinopathy|Vascular Pathology
📊 Meta-Analyses
3 · systematic reviewCRD42022111145 Safety and Diagnostic Utility of Intracoronary Acetylcholine Vasoreactivity Test
→ Acetylcholine vasoreactivity testing for vasomotor
CRD42021245939 Role of alpha7 nicotinic acetylcholine receptor subunit on modulation of energy
CRD42021289721 Use of intracoronary acetylcholine in cardiac catheterization laboratories
→ The use of acetylcholine in Italy for medical purp
How relationships are computed
- Clinical Trials / Meta-Analyses / References: direct foreign-key link via
subject_entity_id(Phase 2d wireup) - Formula ↔ Herbs: text bridge via
formulas.herbs_in_pinyinmatchingherbs.pinyin_name - Herb ↔ Ingredient:
empty — needs
HERB_herb_ingredientimport - Ingredient ↔ Target:
empty — needs
HERB_ingredient_targetimport - Target ↔ Disease:
empty — needs
HERB_target_diseaseimport - Herb → Target → Disease (full chemical spine): awaiting Phase 2e link tables