KEGG   COMPOUND: C16640Help
Entry
C16640                      Compound                               

Name
CAI-1;
Cholerae autoinducer-1
Formula
C13H26O2
Exact mass
214.1933
Mol weight
214.3443
Structure
Mol fileKCF fileDB search
Pathway
map02020  Two-component system
map02024  Quorum sensing
map05111  Biofilm formation - Vibrio cholerae
Other DBs
PubChem: 51090966
ChEBI: 80629
ChEMBL: CHEMBL1922852
NIKKAJI: J2.533.880D
KCF data Show

ATOM        15
            1   C1a C    11.3401  -16.5202
            2   C1b C    12.5525  -15.8202
            3   C1c C    13.7650  -16.5202
            4   C5a C    14.9774  -15.8202
            5   C1b C    16.1898  -16.5202
            6   C1b C    17.4023  -15.8202
            7   C1b C    18.6148  -16.5202
            8   C1b C    19.8272  -15.8202
            9   C1b C    21.0397  -16.5202
            10  C1b C    22.2521  -15.8202
            11  C1b C    23.4646  -16.5202
            12  C1b C    24.6770  -15.8202
            13  C1a C    25.8894  -16.5202
            14  O1a O    13.7650  -17.9200
            15  O5a O    14.9774  -14.4201
BOND        14
            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   12  13 1
            13    3  14 1 #Up
            14    4  15 2

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