KEGG   COMPOUND: C18085
Entry
C18085                      Compound                               
Name
6-Hydroxyangelicin;
Heratomol
Formula
C11H6O4
Exact mass
202.0266
Mol weight
202.1629
Structure
Other DBs
PubChem: 96024302
ChEBI: 81489
NIKKAJI: J142.158A
LinkDB
KCF data

ATOM        15
            1   C8y C    31.0100  -24.1500
            2   C8y C    31.0100  -25.4800
            3   C8y C    32.2000  -26.1800
            4   C8y C    33.4600  -25.4800
            5   C8y C    33.4600  -24.1500
            6   C8x C    32.2000  -23.4500
            7   O7x O    34.6500  -26.1800
            8   C8y C    35.9100  -25.4800
            9   C8x C    35.9100  -24.1500
            10  C8x C    34.6500  -23.4500
            11  O6a O    37.1700  -26.1800
            12  O2x O    29.9600  -26.3900
            13  C8x C    30.5200  -27.6500
            14  C8x C    31.8500  -27.5800
            15  O1a O    29.8200  -23.4500
BOND        17
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 2
            11    5  10 1
            12    8  11 2
            13    2  12 1
            14   12  13 1
            15   13  14 2
            16    3  14 1
            17    1  15 1

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