KEGG   COMPOUND: C01760
Entry
C01760                      Compound                               

Name
(6S,9R)-Vomifoliol;
(6S,9R)-6-Hydroxy-3-oxo-alpha-ionol
Formula
C13H20O3
Exact mass
224.1412
Mol weight
224.2961
Structure
Reaction
Enzyme
Other DBs
CAS: 23526-45-6
PubChem: 4893
ChEBI: 49164
ChEMBL: CHEMBL3315224 CHEMBL463088
KNApSAcK: C00029834
NIKKAJI: J16.949H
KCF data

ATOM        16
            1   C1z C    21.5256  -16.2073
            2   C1z C    20.3003  -15.5081
            3   C2y C    21.5256  -17.6186
            4   C2b C    22.7317  -15.5016
            5   O1a O    22.5854  -17.0401
            6   C1x C    19.0942  -16.2073
            7   C1a C    19.7247  -14.3708
            8   C1a C    20.9868  -14.3655
            9   C2x C    20.3003  -18.3308
            10  C1a C    22.5982  -18.3117
            11  C2b C    23.9442  -16.2010
            12  C5x C    19.0942  -17.6186
            13  C1c C    25.1503  -15.4953
            14  O5x O    17.9517  -18.3817
            15  C1a C    26.3628  -16.1945
            16  O1a O    25.1440  -14.3831
BOND        16
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1 #Down
            5     2   6 1
            6     2   7 1
            7     2   8 1
            8     3   9 2
            9     3  10 1
            10    4  11 2
            11    6  12 1
            12   11  13 1
            13   12  14 2
            14   13  15 1
            15   13  16 1 #Down
            16    9  12 1

» Japanese version

DBGET integrated database retrieval system