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trials · metas · refs
Plus 6,743 TCM formulas connecting herbs together
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⚗️ Ingredient

L-sulforaphane

Open on HERB 2.0 ↗
1
Clinical Trials
0
Meta-Analyses
0
PubMed References
Top Conditions Studied with L-sulforaphane
Chronic Kidney Disease Stage 3|Chronic Kidney Disease Stage 1
📋 Sample Trials
NCT05797506
Safety, Feasibility and Efficacy of Sulforaphane (Avmacol Extra Strength) in Chronic Kidney Disease
Recruiting · Phase 2
📊 Sample Meta-Analyses
None linked yet.
📚 Sample References
None linked yet.
⚗️ All Ingredient data fields for L-sulforaphane
⚗️ Identity
Name
L-sulforaphane
Aliases / Synonyms
(R)-sulforaphane; 142825-10-3; (-)-Sulforaphane; (R)-1-Isothiocyanato-4-(methylsulfinyl)butane; 1-isothiocyanato-4-[(R)-methylsulfinyl]butane; 4-Methylsulfinylbutyl isothiocyanate; CHEBI:47808; CHEMBL128136; GA49J4310U
🧪 Chemistry
Molecular Weight
177.2940
LogP
1.2479
Drug-likeness
0.359
Oral Bioavailability
56.9690
H-Bond Acceptors
3
Rotatable Bonds
5
🔬 Structures
Canonical SMILES
CS(=O)CCCCN=C=S
Isomeric SMILES
C[S@@](=O)CCCCN=C=S
InChIKey
SUVMJBTUFCVSAD-SNVBAGLBSA-N
InChI
InChI=1S/C6H11NOS2/c1-10(8)5-3-2-4-7-6-9/h2-5H2,1H3/t10-/m1/s1
🔗 External References
HERB DB
HBIN033613 ↗
PubChem CID
9577379 ↗
CAS Number
142825-10-3 ↗
NPASS
NPC171713
SymMap
9691
TCMSP
MOL008388
🔍 Raw view — every non-empty column on this row (31 fields)
name
L-sulforaphane
common names
(R)-sulforaphane; 142825-10-3; (-)-Sulforaphane; (R)-1-Isothiocyanato-4-(methylsulfinyl)butane; 1-isothiocyanato-4-[(R)-methylsulfinyl]butane; 4-Methylsulfinylbutyl isothiocyanate; CHEBI:47808; CHEMBL128136; GA49J4310U
herb ingredient id
HBIN033613
canonical smiles
CS(=O)CCCCN=C=S
isomeric smiles
C[S@@](=O)CCCCN=C=S
inchi
InChI=1S/C6H11NOS2/c1-10(8)5-3-2-4-7-6-9/h2-5H2,1H3/t10-/m1/s1
inchikey
SUVMJBTUFCVSAD-SNVBAGLBSA-N
mol wt
177.2940
num h acceptors
3
num h donors
0
mol logp
1.2479
num rotatable bonds
5
drug likeness
0.359
ob score
56.9690
cas id
142825-10-3
symmap mol id
9691
tcmsp ingredient id
MOL008388
pubchem cid
9577379
npass id
NPC171713

📋 Clinical Trials

1 · subject of clinical study
NCT05797506 Safety, Feasibility and Efficacy of Sulforaphane (Avmacol Extra Strength) in Chr
→ Chronic Kidney Disease Stage 3|Chronic Kidney Dise
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_pinyin matching herbs.pinyin_name
  • Herb ↔ Ingredient: ACTIVE — direct link via herb_ingredients
  • Ingredient ↔ Target: ACTIVE — direct link via ingredient_targets
  • Target ↔ Disease: ACTIVE — direct link via target_health_topics
  • Herb → Target → Disease (full chemical spine): ACTIVE — joins all three link tables