KEGG   COMPOUND: C10287Help
Entry
C10287                      Compound                               

Name
Pterostilbene
Formula
C16H16O3
Exact mass
256.1099
Mol weight
256.2964
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00945  Stilbenoid, diarylheptanoid and gingerol biosynthesis
Enzyme
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK13 Aromatic polyketides
   PK1309 Diphenyl ethers, biphenyls, dibenzyls and stilbenes
    C10287  Pterostilbene
Phytochemical compounds [BR:br08003]
 Skimate / acetate-malonate pathway derived compounds
  Stilbenoids
   Stilbenes
    C10287  Pterostilbene
BRITE hierarchy
Other DBs
CAS: 537-42-8
PubChem: 12473
ChEBI: 8630
ChEMBL: CHEMBL83527
LIPIDMAPS: LMPK13090015
KNApSAcK: C00002902
PDB-CCD: 3RL[PDBj]
3DMET: B03709
NIKKAJI: J11.562B
LinkDB All DBs
KCF data Show

ATOM        19
            1   C8x C    21.7601  -16.4625
            2   C8y C    21.7601  -17.8628
            3   C8x C    22.9766  -18.5664
            4   C8y C    24.1858  -17.8628
            5   C8x C    24.1858  -16.4625
            6   C8y C    22.9766  -15.7660
            7   C2b C    25.4000  -18.5654
            8   C2b C    26.6129  -17.8609
            9   C8y C    27.8270  -18.5637
            10  C8x C    27.8260  -19.9591
            11  C8x C    29.0400  -20.6548
            12  C8y C    30.2460  -19.9572
            13  C8x C    30.2450  -18.5571
            14  C8x C    29.0380  -17.8543
            15  O1a O    31.4600  -20.6529
            16  O2a O    22.9783  -14.3659
            17  O2a O    20.5539  -18.5669
            18  C1a C    24.1927  -13.6638
            19  C1a C    19.3401  -17.8640
BOND        20
            1     3   4 1
            2     4   5 2
            3     5   6 1
            4     6   1 2
            5     9  10 2
            6    10  11 1
            7    11  12 2
            8    12  13 1
            9    13  14 2
            10   14   9 1
            11    4   7 1
            12   12  15 1
            13    1   2 1
            14    6  16 1
            15    7   8 2
            16    2  17 1
            17    2   3 2
            18   16  18 1
            19    8   9 1
            20   17  19 1

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