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Ferulic acid-1,2,3-[13C3]

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General Information
Catalog: BLP-000565
CAS: 1261170-81-3
Molecular Formula: C7[13C]3H10O4
Molecular Weight: 197.16

Chemical Structure

Description	Ferulic acid-1,2,3-[13C3] is the labelled analogue of Ferulic Acid. Ferulic Acid is a hydroxycinnamic acid and a type of organic compound found in the Ferula assafoetida L. or Ligusticum chuanxiong. It has many functions such as antioxidant, antimicrobial, anti-inflammatory, anti-thrombosis, anti-diabetic, and anti-cancer activities. Ferulic acid can be used in cosmetics material.
Synonyms	trans-4-Hydroxy-3-methoxycinnamic acid-13C3; Ferulic acid-1,2,3-13C3; DTXSID00746436; (2E)-3-[4-Hydroxy-3-methoxy(1,2,3-13C3)phenyl]prop-2-enoic acid
IUPAC Name	(E)-3-(4-hydroxy-3-methoxy(1,2,3-13C3)cyclohexa-1,3,5-trien-1-yl)prop-2-enoic acid
Related CAS	1135-24-6 (unlabelled)
Canonical SMILES	COC1=C(C=CC(=C1)C=CC(=O)O)O
InChI	InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+/i6+1,7+1,9+1
InChI Key	KSEBMYQBYZTDHS-SQDGEFSZSA-N
Melting Point	168-172 °C
Purity	98% (CP); 99% atom 13C
Storage	−20 °C