KEGG   COMPOUND: C15689
Entry
C15689                      Compound                               
Name
Aureothin;
2-Methoxy-3,5-dimethyl-6-[(2R,4Z)-4-[(2E)-2-methyl-3-(4-nitrophenyl)prop-2-en-1-ylidene]oxolan-2-yl]-4H-pyran-4-one
Formula
C22H23NO6
Exact mass
397.1525
Mol weight
397.4211
Structure
Sequence
0 Pba  1 Mtd  2 Mte  3 Man  4 Mtn  5 Mtn
  Gene
0-2 aurA [UP:Q70KH8]; 3 aurB [UP:Q70KH5]; 4-5 aurC [UP:Q70KH4]
  Organism
Streptomyces thioluteus
  Type
PK
Reaction
R12324 R12326
Enzyme
1.14.15.37
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK09 Polyether antibiotics
   C15689  Aureothin
Other DBs
CAS: 2825-00-5
PubChem: 47205015
ChEBI: 80024
LIPIDMAPS: LMPK09000036
PDB-CCD: HQW[PDBj]
NIKKAJI: J12.863E
LinkDB
KCF data

ATOM        29
            1   C8x C    15.1200  -16.5200
            2   C8y C    15.1200  -17.9200
            3   C8x C    16.3324  -18.6200
            4   C8x C    17.5449  -17.9200
            5   C8y C    17.5449  -16.5200
            6   C8x C    16.3324  -15.8200
            7   N2b N    13.9076  -18.6200 #+
            8   O3a O    12.7121  -17.9296 #-
            9   O3a O    13.9075  -20.0198
            10  C2b C    18.7824  -15.8200
            11  C2c C    19.9949  -16.5200
            12  C2b C    21.2073  -15.8200
            13  C2y C    22.4197  -16.5200
            14  C1a C    19.9949  -17.9198
            15  C1x C    22.5658  -17.9101
            16  O2x O    23.9331  -18.2008
            17  C1y C    24.6320  -16.9903
            18  C1x C    23.6967  -15.9515
            19  C8y C    26.0300  -16.8433
            20  O2x O    26.8692  -17.9980
            21  C8y C    28.2615  -17.8515
            22  C8y C    28.8308  -16.5724
            23  C8y C    27.9916  -15.4177
            24  C8y C    26.5993  -15.5642
            25  C1a C    25.7648  -14.4164
            26  C1a C    30.2302  -16.4250
            27  O5x O    28.5688  -14.1208
            28  O2a O    29.0902  -18.9918
            29  C1a C    30.5142  -18.8424
BOND        31
            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     2   7 1
            8     7   8 1
            9     7   9 2
            10    5  10 1
            11   10  11 2
            12   11  12 1
            13   12  13 2
            14   11  14 1
            15   13  15 1
            16   15  16 1
            17   16  17 1
            18   17  18 1
            19   13  18 1
            20   17  19 1
            21   19  20 1
            22   20  21 1
            23   21  22 2
            24   22  23 1
            25   23  24 1
            26   19  24 2
            27   24  25 1
            28   22  26 1
            29   23  27 2
            30   21  28 1
            31   28  29 1

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