C10763

Entry

C10763                      Compound

Name

Cytisine

Formula

C11H14N2O

Exact mass

190.1106

Mol weight

190.2417

Structure

Remark

Same as:

D07770

Reaction

R08420

Pathway

map00960

Tropane, piperidine and pyridine alkaloid biosynthesis

map01064

Biosynthesis of alkaloids derived from ornithine, lysine and nicotinic acid

map01110

Biosynthesis of secondary metabolites

Brite

Phytochemical compounds [BR:br08003]
Alkaloids
  Alkaloids derived from lysine
   Quinolizidine alkaloids
    C10763  Cytisine
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
N NERVOUS SYSTEM
  N07 OTHER NERVOUS SYSTEM DRUGS
   N07B DRUGS USED IN ADDICTIVE DISORDERS
    N07BA Drugs used in nicotine dependence
     N07BA04 Cytisinicline
      D07770  Cytisinicline (USAN)
Target-based classification of drugs [BR:br08310]
Ion channels
  Ligand-gated ion channels
   Acetylcholine (nicotinic)
    CHRN
     D07770  Cytisinicline (USAN)

Other DBs

CAS:

485-35-8

PubChem:

12946

ChEBI:

4055

KNApSAcK:

C00002218

3DMET:

B05480

NIKKAJI:

J9.571K

KCF data

ATOM        14
            1   C8x C    23.6831  -16.6458
            2   C8x C    23.6831  -18.0454
            3   C8y C    24.8982  -18.7452
            4   C8x C    24.8982  -15.9460
            5   C8y C    26.1060  -16.6458
            6   N4y N    26.1001  -18.0454
            7   C1x C    27.3092  -18.7503
            8   C1y C    28.5242  -18.0557
            9   C1x C    28.5303  -16.6561
            10  C1y C    27.3212  -15.9513
            11  C1x C    28.5252  -15.2391
            12  N1x N    29.7411  -15.9248
            13  C1x C    29.7268  -17.3456
            14  O5x O    24.9549  -20.1448
BOND        16
            1     5   4 2
            2     4   1 1
            3     5   6 1
            4     6   7 1
            5     7   8 1
            6     8   9 1 #Down
            7    10   9 1 #Down
            8    10   5 1
            9    10  11 1
            10    8  13 1
            11   11  12 1
            12    1   2 2
            13    2   3 1
            14   12  13 1
            15    3   6 1
            16    3  14 2