KEGG   COMPOUND: C15268
Entry
C15268                      Compound                               
Name
trans-2-(4-Nitrophenyl)-3-phenyloxirane;
trans- alpha,alpha'-Epoxy-4-nitrobibenzyl;
trans-4-Nitrostilbene oxide
Formula
C14H11NO3
Exact mass
241.0739
Mol weight
241.242
Structure
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK13 Aromatic polyketides
   PK1309 Diphenyl ethers, biphenyls, dibenzyls and stilbenes
    C15268  trans-2-(4-Nitrophenyl)-3-phenyloxirane
Other DBs
CAS: 14985-26-3
PubChem: 17396265
ChEBI: 79770
LIPIDMAPS: LMPK13090027
NIKKAJI: J595.103H
LinkDB
KCF data

ATOM        18
            1   C8x C    20.9202  -18.5378
            2   C8x C    20.9202  -19.9369
            3   C8x C    22.1318  -20.6365
            4   C8x C    23.3435  -19.9369
            5   C8y C    23.3435  -18.5378
            6   C8x C    22.1318  -17.8383
            7   C1y C    24.5738  -17.8273
            8   C1y C    25.9729  -17.8273
            9   O2x O    25.2734  -16.6156
            10  C8y C    27.1772  -18.5226
            11  C8x C    27.1774  -19.9366
            12  C8x C    28.3891  -20.6360
            13  C8y C    29.6007  -19.9362
            14  C8x C    29.6004  -18.5224
            15  C8x C    28.3887  -17.8229
            16  N2b N    30.8081  -20.6331 #+
            17  O3a O    30.8084  -22.0353
            18  O3a O    31.9998  -19.9446 #-
BOND        20
            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     7   5 1 #Down
            8     7   8 1
            9     7   9 1
            10    8   9 1
            11    8  10 1 #Up
            12   10  11 2
            13   11  12 1
            14   12  13 2
            15   13  14 1
            16   14  15 2
            17   10  15 1
            18   13  16 1
            19   16  17 2
            20   16  18 1

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