KEGG COMPOUND: C00719

COMPOUND: C00719

Entry

C00719                      Compound

Name

Betaine;
Trimethylaminoacetate;
Glycine betaine;
N,N,N-Trimethylglycine;
Trimethylammonioacetate

Formula

C5H11NO2

Exact mass

117.0790

Mol weight

117.15

Structure

Remark

Same as:

D07523

Reaction

R02565 R02566 R02821 R07228 R07244 R08211 R08212 R10061
R10062 R12614 R12787 R13016 R13307

Pathway

map00260

Glycine, serine and threonine metabolism

map01100

Metabolic pathways

map02010

ABC transporters

Module

M00555

Betaine biosynthesis, choline => betaine

M00974

Betaine metabolism, animals, betaine => glycine

M00975

Betaine degradation, bacteria, betaine => pyruvate

Network

nt06033 Glycine, serine and arginine metabolism

Enzyme

1.1.3.17        1.2.1.8         1.13.11.90      1.14.13.251
1.21.4.4        2.1.1.5         2.1.1.157       2.1.1.161
2.1.1.162       2.1.1.376       3.1.2.33

Brite

Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
A ALIMENTARY TRACT AND METABOLISM
  A16 OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
   A16A OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
    A16AA Amino acids and derivatives
     A16AA06 Betaine
      D07523  Betaine (JAN) <JP/US>
USP drug classification [BR:br08302]
Genetic, Enzyme, or Protein Disorder: Replacement, Modifiers, Treatment
  Betaine
   D07523  Betaine (JAN)
Therapeutic category of drugs in Japan [BR:br08301]
3  Agents affecting metabolism
  39  Other agents affecting metabolism
   399  Miscellaneous
    3999  Others
     D07523  Betaine (JAN)
Risk category of Japanese OTC drugs [BR:br08312]
Third-class OTC drugs
  Inorganic and organic chemicals
   Betaine
    D07523  Betaine (JAN)
New drug approvals in Europe [br08329.html]
European public assessment reports (EPAR) authorised medicine
  D07523
New drug approvals in Japan [br08318.html]
Drugs with new active ingredients
  D07523
New drug approvals in the USA, Europe and Japan [br08328.html]
Approval dates by FDA, EMA and PMDA
  D07523

Other DBs

CAS:

107-43-7

PubChem:

3985

ChEBI:

17750

KNApSAcK:

C00007291

PDB-CCD:

BET[PDBj]

NIKKAJI:

J5.058J

KCF data

ATOM        8
            1   N1d N    25.9158  -16.0186 #+
            2   C1b C    27.1247  -16.7218
            3   C1a C    24.7013  -16.7218
            4   C1a C    25.9158  -14.6182
            5   C6a C    28.3392  -16.0186
            6   O6a O    28.3392  -14.6182
            7   O6a O    29.5478  -16.7218 #-
            8   C1a C    24.6962  -15.3153
BOND        7
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     5   6 2
            6     5   7 1
            7     1   8 1

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