KEGG   COMPOUND: C00120
Entry
C00120                      Compound                               
Name
Biotin;
D-Biotin;
Vitamin H;
Coenzyme R
Formula
C10H16N2O3S
Exact mass
244.0882
Mol weight
244.3106
Structure
Remark
Same as: D00029
Reaction
Pathway
map00780  Biotin metabolism
map01100  Metabolic pathways
map01240  Biosynthesis of cofactors
map02010  ABC transporters
map04977  Vitamin digestion and absorption
Module
M00123  Biotin biosynthesis, pimeloyl-ACP/CoA => biotin
M00573  Biotin biosynthesis, BioI pathway, long-chain-acyl-ACP => pimeloyl-ACP => biotin
M00577  Biotin biosynthesis, BioW pathway, pimelate => pimeloyl-CoA => biotin
M00950  Biotin biosynthesis, BioU pathway, pimeloyl-ACP/CoA => biotin
Enzyme
1.-.-.-         2.8.1.6         3.5.1.12        6.2.1.11        
6.3.4.9         6.3.4.10        6.3.4.11        6.3.4.15
Brite
Compounds with biological roles [BR:br08001]
 Vitamins and cofactors
  Cofactors
   Coenzymes
    C00120  Biotin
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A11 VITAMINS
   A11H OTHER PLAIN VITAMIN PREPARATIONS
    A11HA Other plain vitamin preparations
     A11HA05 Biotin
      D00029  Biotin (JP18/USP/INN) <JP>
Therapeutic category of drugs in Japan [BR:br08301]
 3  Agents affecting metabolism
  31  Vitamins
   319  Miscellaneous vitamins
    3190  Miscellaneous vitamins
     D00029  Biotin (JP18/USP/INN)
Risk category of Japanese OTC drugs [BR:br08312]
 Third-class OTC drugs
  Inorganic and organic chemicals
   Biotin
    D00029  Biotin (JP18/USP/INN)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00029  Biotin
Other DBs
CAS: 58-85-5
PubChem: 3420
ChEBI: 15956
KNApSAcK: C00000756
PDB-CCD: BTN[PDBj]
3DMET: B01165
NIKKAJI: J94.599D
KCF data

ATOM        16
            1   C1y C    18.7455  -17.4465
            2   C1y C    17.3492  -17.4348
            3   C1y C    19.1779  -18.7728
            4   N1x N    19.1896  -16.1086
            5   N1x N    16.9110  -16.1086
            6   C1x C    16.9110  -18.7611
            7   S2x S    18.0444  -19.5907
            8   C1b C    20.3931  -19.4680
            9   C5x C    18.0503  -15.2789
            10  C1b C    21.6025  -18.7728
            11  O5x O    18.0503  -13.8709
            12  C1b C    22.8119  -19.4680
            13  C1b C    24.0214  -18.7728
            14  C6a C    25.2308  -19.4680
            15  O6a O    26.4402  -18.7728
            16  O6a O    25.2308  -20.8702
BOND        17
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     3   8 1 #Down
            8     4   9 1
            9     8  10 1
            10    9  11 2
            11   10  12 1
            12   12  13 1
            13   13  14 1
            14   14  15 1
            15   14  16 2
            16    5   9 1
            17    6   7 1

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