cis-Urocanic acid - Moligand™,≥98% , CAS No.7699-35-6

CAS: 7699-35-6 Cat. No.: C337896 Molecular Weight: 138.12
AVAILABLE TO ORDER
GRADE & PURITY Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
Synonyms
AKOS030532710 | 5LM7WD7VIC | HY-113008A | Q27113993 | SCHEMBL12963908 | (Z)-3-(1H-imidazol-5-yl)prop-2-enoic acid | (2Z)-3-(1H-imidazol-4-yl)prop-2-enoic acid | cis-3-(1H-imidazol-4-yl)-2-propenoic acid | Urocanic acid, cis- | (E)-3-(3H-IMIDAZOL-4-YL)PROP
Storage
Protected from light,Store at -20°C
Shipped In
Ice chest + Ice pads
Size
Status
Price
Qty
1mg
C337896-1mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$218.90
5mg
C337896-5mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$459.90
25mg
C337896-25mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$1,069.90
100mg
C337896-100mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$1,949.90
500mg
C337896-500mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$3,889.90
Enter a quantity for the sizes you want to add.
🧪

Why this grade

Moligand™,≥98% Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Protected from light,Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

This 5-HT agonist is a product of uv isomerization of trans-urocanic acid in skin. This leads to immunosuppression via activation of 5-HT2A receptor.

Specifications

Synonyms
AKOS030532710 | 5LM7WD7VIC | HY-113008A | Q27113993 | SCHEMBL12963908 | (Z)-3-(1H-imidazol-5-yl)prop-2-enoic acid | (2Z)-3-(1H-imidazol-4-yl)prop-2-enoic acid | cis-3-(1H-imidazol-4-yl)-2-propenoic acid | Urocanic acid, cis- | (E)-3-(3H-IMIDAZOL-4-YL)PROP
Specifications & Purity
Moligand™, ≥98%
Storage
Protected from light, Store at -20°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Grade
Moligand™
Action Type
AGONIST
Purity
≥98%
Names and Identifiers
Canonical SmilesC1=C(NC=N1)C=CC(=O)O
IUPAC Name(Z)-3-(1H-imidazol-5-yl)prop-2-enoic acid
InChIKeyLOIYMIARKYCTBW-UPHRSURJSA-N
INCHI1S/C6H6N2O2/c9-6(10)2-1-5-3-7-4-8-5/h1-4H,(H,7,8)(H,9,10)/b2-1-
Isomeric SMILES C1=C(NC=N1)/C=C\C(=O)O
Alternate CAS 3465-72-3;104-98-3
Molecular Weight 138.12
Reaxy-Rn 606934
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=606934&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassAzoles
SubclassImidazoles
Intermediate Tree Nodes Substituted imidazoles
Direct ParentImidazolyl carboxylic acids and derivatives
Alternative Parents Heteroaromatic compounds  Monocarboxylic acids and derivatives  Carboxylic acids  Azacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Imidazolyl carboxylic acid derivative - Heteroaromatic compound - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as imidazolyl carboxylic acids and derivatives. These are organic compounds containing a carboxylic acid chain (of at least 2 carbon atoms) linked to an imidazole ring.
External Descriptors urocanic acid
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
CYP3A4 Tclin Cytochrome P450 3A4 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
TSHR Tclin Thyroid stimulating hormone receptor (29986 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP2D6 Tclin Cytochrome P450 2D6 (33882 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP1A2 Tchem Cytochrome P450 1A2 (26471 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP2C9 Tchem Cytochrome P450 2C9 (32119 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP2C19 Tchem Cytochrome P450 2C19 (29246 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
Hdac6 Histone deacetylase 6 (222 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
rep Replicase polyprotein 1ab (378 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
SolubilitySoluble in Water: >10 mg/mL
Sensitivitylight sensitive
Molecular Weight138.120 g/mol
XLogP30.000
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass138.043 Da
Monoisotopic Mass138.043 Da
Topological Polar Surface Area66.000 Ų
Heavy Atom Count10
Formal Charge0
Complexity156.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds1
Covalently-Bonded Unit Count1
Solution Calculators
Reviews

Customer Reviews

Shall we send you a message when we have discounts available?

Remind me later

Thank you! Please check your email inbox to confirm.

Oops! Notifications are disabled.