KEGG   COMPOUND: C05179Help
Entry
C05179                      Compound                               

Name
Salutaridine;
Sinoacutine;
5,6,8,14-Tetradehydro-4-hydroxy-3,6-dimethoxy-17-methyl-morphinan-7-one
Formula
C19H21NO4
Exact mass
327.1471
Mol weight
327.3743
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Isoquinoline alkaloid biosynthesis
Metabolic pathways
Biosynthesis of secondary metabolites
Enzyme
1.1.1.248       1.14.21.4
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tyrosine
   Isoquinoline alkaloids
    C05179  Salutaridine
BRITE hierarchy
Other DBs
CAS: 
1936-18-1
PubChem: 
ChEBI: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        24
            1   C1z C    25.8244  -20.6436
            2   C8y C    25.8244  -19.2802
            3   C2y C    26.9955  -21.3312
            4   C2x C    24.6416  -21.3137
            5   C1x C    26.9955  -19.9504
            6   C8y C    27.0012  -18.6044
            7   C8y C    24.6416  -18.6044
            8   C1y C    28.1782  -20.6495
            9   C2x C    26.9895  -22.6888
            10  C2y C    24.6299  -22.6712
            11  C1x C    29.3493  -19.9678
            12  C1x C    28.1840  -19.2919
            13  C8x C    27.0012  -17.2410
            14  C8y C    24.6416  -17.2410
            15  O1a O    23.4588  -19.2919
            16  N1y N    29.3610  -21.3371
            17  C5x C    25.8068  -23.3587
            18  O2a O    23.4472  -23.3471
            19  C8x C    25.8301  -16.5535
            20  O2a O    23.4588  -16.5535
            21  C1a C    30.6777  -20.9758
            22  O5x O    25.7953  -24.7280
            23  C1a C    22.2701  -22.6596
            24  C1a C    22.2761  -17.2352
BOND        27
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1 #Up
            5     2   6 1
            6     2   7 2
            7     3   8 1
            8     3   9 2
            9     4  10 2
            10    5  11 1
            11    6  12 1
            12    6  13 2
            13    7  14 1
            14    7  15 1
            15    8  16 1 #Up
            16    9  17 1
            17   10  18 1
            18   13  19 1
            19   14  20 1
            20   16  21 1
            21   17  22 2
            22   18  23 1
            23   20  24 1
            24    8  12 1
            25   10  17 1
            26   11  16 1
            27   14  19 2

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