KEGG   COMPOUND: C21044
Entry
C21044                      Compound                               
Name
3-Deoxy-lyxo-heptulosaric acid;
3-Deoxy-D-lyxo-hept-2-ulopyranosaric acid
Formula
C7H10O8
Exact mass
222.0376
Mol weight
222.1495
Structure
Other DBs
PubChem: 254816269
ChEBI: 190722
LinkDB
KCF data

ATOM        15
            1   C1z C    19.8710  -15.5287
            2   O2x O    18.7283  -14.8670
            3   C1x C    19.8710  -16.8435
            4   C6a C    21.0005  -14.8670
            5   C1y C    17.5874  -15.5287
            6   C1y C    18.7283  -17.5224
            7   O6a O    20.9715  -13.5579
            8   O6a O    22.1303  -15.5287
            9   C1y C    17.5874  -16.8435
            10  O1a O    18.7342  -18.8259
            11  C6a C    16.3883  -14.8156
            12  O1a O    16.1775  -17.8043
            13  O6a O    15.1858  -15.4968
            14  O1a O    21.3685  -16.7929
            15  O6a O    16.4027  -13.4402
BOND        15
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     3   6 1
            6     4   7 1
            7     4   8 2
            8     5   9 1
            9     6  10 1 #Up
            10    6   9 1
            11    5  11 1 #Up
            12    9  12 1 #Up
            13   11  13 1
            14    1  14 1 #Either
            15   11  15 2

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