C00246

Entry

C00246                      Compound

Name

Butanoic acid;
Butanoate;
Butyrate;
Butyric acid

Formula

C4H8O2

Exact mass

88.0524

Mol weight

88.1051

Structure

Reaction

R01176 R01179 R01365 R01688 R01689 R01690 R03781 R04119

Pathway

map00650

Butanoate metabolism

map01100

Metabolic pathways

map04973

Carbohydrate digestion and absorption

map04974

Protein digestion and absorption

Enzyme

1.3.1.31 2.7.2.7 2.8.3.8 2.8.3.9
3.1.1.51 3.6.1.20 3.7.1.7 6.2.1.2

Brite

Compounds with biological roles [BR:br08001]
Organic acids
  Carboxylic acids
   Monocarboxylic acids
    C00246  Butyrate; Butanoate
Lipids
  Fatty acids
   Saturated fatty acids
    C00246  Butyric acid (4:0)
Lipids [BR:br08002]
FA  Fatty acyls
  FA01 Fatty Acids and Conjugates
   FA0101 Straight chain fatty acids
    C00246  Butanoic acid
Phytochemical compounds [BR:br08003]
Fatty acids related compounds
  Fatty acids
   Saturated fatty acids
    C00246  Butyric acid

Other DBs

CAS:

107-92-6

PubChem:

3545

ChEBI:

17968 30772

LIPIDMAPS:

LMFA01010004

KNApSAcK:

C00001180

PDB-CCD:

BUA[PDBj]

3DMET:

B00070

NIKKAJI:

J4.068A

KCF data

ATOM        6
            1   C1b C    25.6079  -16.8921
            2   C6a C    24.4028  -16.1935
            3   C1b C    26.8246  -16.1935
            4   O6a O    23.1862  -16.8921
            5   O6a O    24.4028  -14.7905
            6   C1a C    28.0356  -16.8921
BOND        5
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     2   5 2
            5     3   6 1