Ferulic acid


PubChem CID 445858
Molecular Formula C10H10O4
Structure Compound Image
Synonyms
ferulic acid
trans-Ferulic Acid
1135-24-6
537-98-4
4-Hydroxy-3-methoxycinnamic acid
trans-4-Hydroxy-3-methoxycinnamic acid
3-(4-Hydroxy-3-methoxyphenyl)acrylic acid
(E)-Ferulic acid
ferulate
Coniferic acid
2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-
Ferulic acid, trans-
3-(4-Hydroxy-3-methoxyphenyl)-2-propenoic acid
(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid
Cinnamic acid, 4-hydroxy-3-methoxy-
3-methoxy-4-hydroxycinnamic acid
(E)-3-(4-Hydroxy-3-methoxyphenyl)-2-propenoic acid
2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-, (2E)-
Cinnamic acid, 4-hydroxy-3-methoxy-, (E)-
(E)-4-Hydroxy-3-methoxycinnamic acid
UNII-AVM951ZWST
(E)-4'-Hydroxy-3'-methoxycinnamic acid
AVM951ZWST
4-Hydroxy-3-methoxy cinnamic acid
EINECS 208-679-7
Cinnamic acid, 4-hydroxy-3-methoxy-, trans-
MFCD00004400
2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-, (E)-
(E)-3-(4-hydroxy-3-methoxyphenyl)acrylic acid
CCRIS 3256
CCRIS 7127
CHEBI:17620
(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid
HSDB 7663
NSC 2821
NSC-2821
EINECS 214-490-0
NSC 51986
NSC-51986
(2E)-3-(4-Hydroxy-3-methoxyphenyl)acrylic acid
NSC 674320
4-Hydroxy-3-methoxycinnamate
(2E)-3-(4-Hydroxy-3-methoxyphenyl)-2-propenoic acid
(E)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoic acid
CHEMBL32749
3-(4-Hydroxy-3-methoxyphenyl)propenoic acid
NSC2821
Trans-3-(4-hydroxy-3-methoxyphenyl)acrylic acid
3-Methoxy-4-hydroxy-trans-cinnamate
NSC-674320
97274-61-8
3-methoxy-4-hydroxy-trans-cinnamic acid
(E)-Ferulate
trans-Ferulic Acid (purified by sublimation)
FERULIC ACID (USP-RS)
FERULIC ACID [USP-RS]
CINNAMIC ACID,4-HYDROXY,3-METHOXY FERULIC ACID
Fumalic acid
ferulic acid, (E)-isomer
SMR000112202
3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid
DTXSID5040673
ferulasaure
Ferulicacid
trans-Ferulate
(E)-3-(4-Hydroxy-3-methoxyphenyl)-2-propenoate
CCRIS 7575
trans-FerulicAcid
Ferulic acid, E-
Ferulic acid (M5)
Ferulic Acid ,(S)
FERULIC-ACID
CURCUMIN_met040
Spectrum5_000554
bmse000459
bmse000587
bmse010211
FERULIC ACID [MI]
trans-Ferulic acid, 99%
FERULIC ACID [HSDB]
Fumalic acid (Ferulic acid)
SCHEMBL15673
BSPBio_003168
MLS001066385
MLS001332483
MLS001332484
MLS002207079
MLS006011435
SPECTRUM1501017
trans-Ferulic acid, >=99%
Fumalic acid (Ferulic acid)?
FERULIC ACID [WHO-DD]
DTXCID3020673
DTXSID70892035
HMS1921D05
HMS2269P04
(E)-4-Hydroxy-3-methoxycinnamate
trans-4-Hydroxy-3-methoxycinnamate
ALBB-013505
BCP21231
BCP21789
HY-N0060
NSC51986
STR00961
(E)-4-hydroxy-3-methoxy-Cinnamate
TRANS-FERULIC ACID [WHO-DD]
(E)4-hydroxy-3-methoxycinnamic acid
AC7905
BBL010345
BDBM50214744
CCG-38860
s2300
STK801551
AKOS000263735
AC-7965
BCP9000163
DB07767
PS-3435
SDCCGMLS-0066667.P001
trans-3-methoxy-4-hydroxycinnamic acid
(E)-4-hydroxy-3-methoxy-Cinnamic acid
3-(4-Hydroxy-3-methoxyphenyl)propenoate
4-Hydroxy-3-methoxycinnamic acid, trans
NCGC00094889-01
NCGC00094889-02
NCGC00094889-03
NCGC00094889-04
NCGC00094889-12
1ST40035
AC-10321
BS-17543
SMR004703246
AM20060784
CS-0007108
F1257
H0267
NS00068201
SW219616-1
EN300-16798
C01494
F-2000
propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-
A829775
FERULIC ACID (CONSTITUENT OF BLACK COHOSH)
Q417362
SR-01000765539
(2E)-3-(4-Hydroxy-3-methoxyphenyl)-2-propenoate
(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoicacid
J-002980
SR-01000765539-3
BRD-K66295376-001-12-3
BRD-K66295376-001-13-1
BRD-K66295376-236-01-8
Z56782558
FERULIC ACID (CONSTITUENT OF BLACK COHOSH) [DSC]
055E203F-B305-4B7F-8CE7-F9C0C03AB609
2',4-DIHYDROXY-3,4',6'-TRIMETHOXYCHALCONE_met028
3986A1BE-A670-4B06-833B-E17253079FD8
Ferulic acid, European Pharmacopoeia (EP) Reference Standard
trans-Ferulic acid, certified reference material, TraceCERT(R)
Ferulic acid, United States Pharmacopeia (USP) Reference Standard
trans-Ferulic acid, matrix substance for MALDI-MS, >=99.0% (HPLC)
Ferulic Acid, Pharmaceutical Secondary Standard; Certified Reference Material
InChI=1/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13

Computed Descriptors


IUPAC Name (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid
SMILES COC1=C(C=CC(=C1)/C=C/C(=O)O)O
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+
InChIKey KSEBMYQBYZTDHS-HWKANZROSA-N

Computed Properties

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Molecular Weight 194.18 g/mol
XLogP3 1.5
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 194.058
Monoisotopic Mass 194.058
Topological Polar Surface Area 66.8
Heavy Atom Count 14
Formal Charge 0
Complexity 224
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1

Annotation

  • D000893 - Anti-Inflammatory Agents|D000975 - Antioxidants
  • D016166 - Free Radical Scavengers|D002317 - Cardiovascular Agents
  • D000959 - Antihypertensive Agents|D002491 - Central Nervous System Agents
  • D000700 - Analgesics|D005765 - Gastrointestinal Agents
  • D002756 - Cholagogues and Choleretics|D006401 - Hematologic Agents
  • D000925 - Anticoagulants|D018373 - Peripheral Nervous System Agents
  • D018689 - Sensory System Agents|D018501 - Antirheumatic Agents|D019995 - Laboratory Chemicals
  • D007202 - Indicators and Reagents|D020011 - Protective Agents
  • D000975 - Antioxidants
  • 1 pairs of Verified P450 and Ferulic acid


    Insect Gene Symbol Validation Reference
    Spodoptera frugiperda CYP321A9 R