KEGG   COMPOUND: C06347
Entry
C06347                      Compound                               
Name
(R)-Norcoclaurine;
6,7-Dihydroxy-(1R)-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline;
(+)-Demethylcoclaurine
Formula
C16H17NO3
Exact mass
271.1208
Mol weight
271.31
Structure
Other DBs
CAS: 106032-53-5
PubChem: 8583
ChEBI: 27751
KNApSAcK: C00001846 C00049556
NIKKAJI: J444.133H
LinkDB
KCF data

ATOM        20
            1   C8y C    25.5082  -19.0992
            2   C1y C    26.7226  -18.3985
            3   C8y C    25.5023  -20.5062
            4   C8x C    24.2937  -18.3928
            5   C1b C    26.7285  -17.0032
            6   N1x N    27.9371  -19.1108
            7   C8x C    24.2937  -21.2011
            8   C1x C    26.7109  -21.2068
            9   C8y C    23.0735  -19.0992
            10  C8y C    27.9428  -16.3083
            11  C1x C    27.9312  -20.5179
            12  C8y C    23.0735  -20.5062
            13  O1a O    21.8649  -18.4045
            14  C8x C    29.1457  -17.0149
            15  C8x C    27.9428  -14.9130
            16  O1a O    21.8649  -21.2068
            17  C8x C    30.3600  -16.3200
            18  C8x C    29.1572  -14.2240
            19  C8y C    30.3658  -14.9247
            20  O1a O    31.5743  -14.2300
BOND        22
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1 #Up
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     5  10 1
            10    6  11 1
            11    7  12 2
            12    9  13 1
            13   10  14 2
            14   10  15 1
            15   12  16 1
            16   14  17 1
            17   15  18 2
            18   17  19 2
            19   19  20 1
            20    8  11 1
            21    9  12 1
            22   18  19 1

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