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(3-Formyl-1-indolyl)acetic acid
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(3-Formyl-1-indolyl)acetic acid

CAS: 138423-98-0

Ref. 3D-FF49821

5g
108.00 €
25g
202.00 €
50g
345.00 €
100g
541.00 €
250g
1,079.00 €
Estimated delivery in United States, on Monday 22 Apr 2024

Product Information

Name:
(3-Formyl-1-indolyl)acetic acid
Synonyms:
  • 1-(Carboxymethyl)indole-3-carboxaldehydeIndole-N-acetic acid-3-carboxaldehyde
  • (3-Formyl-1-Indolyl)Acetic Acid
  • (3-Formyl-1-indolyl)aceticacid
  • (3-Formyl-Indol-1-Yl)-Acetic Acid
  • (3-formyl-1H-indol-1-yl)acetic acid
  • 1-Acetic Acid Indole-3-Carboxaldehyde
  • 1H-Indole-1-acetic acid, 3-formyl-
  • 2-(3-Formyl-1H-indol-1-yl)acetic acid
  • 2-(3-Formylindol-1-yl)acetic acid
  • 3-Formyl Indoleacetic Acid
  • See more synonyms
  • 3-Formyl-1H-indole-1-acetic acid
  • 3-Formylindol-1-yl-Acetic Acid
  • 3-Formylindole-1-Yl-Acetic Acid
  • 3-Formylindole-N-acetic acid
  • Chembrdg-Bb 4002661
  • Timtec-Bb Sbb010076
Description:

(3-Formyl-1-indolyl)acetic acid is a small molecule that has been shown to inhibit the activity of various enzymes, including acetylcholinesterase (AChE), butyrylcholinesterase (BChE), and histamine N-methyltransferase (HNMT). The crystal structure of (3-formyl-1-indolyl)acetic acid was determined by X-ray crystallography. The active conformation of the molecule was found to be a nonplanar chair conformation with a hydrogen bond acceptor at C8. This conformation is stabilized by a hydrogen bond donor at C7, which also creates an additional hydrogen bond acceptor at O2. These interactions stabilize the molecule in its active form. The docking studies showed that the ligand binds to AChE with high affinity, while binding to BChE and HNMT with lower affinity. The inhibition effects on these

Brand:
Biosynth
Long term storage:
Notes:

Chemical properties

Molecular weight:
203.19 g/mol
Formula:
C11H9NO3
Purity:
Min. 95%
Color/Form:
Off-White Powder
InChI:
InChI=1S/C11H9NO3/c13-7-8-5-12(6-11(14)15)10-4-2-1-3-9(8)10/h1-5,7H,6H2,(H,14,15)
InChI key:
InChIKey=ZUUGBTJTGRTIFK-UHFFFAOYSA-N
SMILES:
O=Cc1cn(CC(=O)O)c2ccccc12
MDL:
Melting point:
Boiling point:
Flash point:
Density:
Concentration:
EINECS:
Merck:
HS code:

Hazard Info

UN Number:
EQ:
Class:
H Statements:
P Statements:
Forbidden to fly:
Hazard Info:
Packing Group:
LQ:

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