KEGG   COMPOUND: C17229
Entry
C17229                      Compound                               
Name
Pentahomomethionine;
L-Pentahomomethionine
Formula
C10H21NO2S
Exact mass
219.1293
Mol weight
219.3442
Structure
Reaction
Pathway
map00966  Glucosinolate biosynthesis
map01210  2-Oxocarboxylic acid metabolism
Enzyme
1.14.14.42      2.6.1.-
Other DBs
PubChem: 96023637
ChEBI: 50713
KNApSAcK: C00007652
NIKKAJI: J2.806.127G
LinkDB
KCF data

ATOM        14
            1   C1a C    11.9701  -16.5201
            2   S2a S    13.1825  -15.8201
            3   C1b C    14.3950  -16.5201
            4   C1b C    15.6074  -15.8201
            5   C1b C    16.8198  -16.5201
            6   C1b C    18.0323  -15.8201
            7   C1b C    19.2447  -16.5201
            8   C1b C    20.4571  -15.8201
            9   C1b C    21.6696  -16.5201
            10  C1c C    22.8820  -15.8201
            11  C6a C    24.0945  -16.5201
            12  O6a O    25.3069  -15.8201
            13  O6a O    24.0945  -17.9200
            14  N1a N    22.8820  -14.4201
BOND        13
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11   11  12 1
            12   11  13 2
            13   10  14 1 #Up

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