KEGG   COMPOUND: C20513
Entry
C20513                      Compound                               
Name
6-Hydroxytryprostatin B;
Desmethyltryprostatin A
Formula
C21H25N3O3
Exact mass
367.1896
Mol weight
367.4415
Structure
Reaction
R10321 R10588
Pathway
map00404  Staurosporine biosynthesis
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Module
M00786  Fumitremorgin alkaloid biosynthesis, tryptophan + proline => fumitremorgin C/A
Enzyme
1.14.14.118     2.1.1.293
Other DBs
PubChem: 172232262
LinkDB
KCF data

ATOM        27
            1   C1y C    19.5612  -14.2689
            2   N1x N    19.5612  -15.6768
            3   C5x C    20.7805  -16.3808
            4   C1y C    21.9998  -15.6768
            5   N1y N    21.9998  -14.2689
            6   C5x C    20.7805  -13.5650
            7   C1x C    23.3389  -16.1119
            8   C1x C    24.1664  -14.9729
            9   C1x C    23.3389  -13.8339
            10  C1b C    18.3420  -13.5650
            11  C8y C    17.1397  -14.2593
            12  C8y C    15.8805  -13.6987
            13  C8y C    14.9583  -14.7231
            14  N4x N    15.6476  -15.9167
            15  C8y C    16.9957  -15.6301
            16  C8x C    15.4453  -12.3598
            17  C8x C    14.0682  -12.0672
            18  C8y C    13.1460  -13.0915
            19  C8x C    13.5811  -14.4305
            20  O5x O    20.7805  -12.1571
            21  O5x O    20.7805  -17.7887
            22  C1b C    18.0471  -16.5768
            23  C2b C    17.7503  -17.9753
            24  C2c C    18.7981  -18.9183
            25  C1a C    20.1278  -18.7675
            26  C1a C    18.5058  -20.2946
            27  O1a O    11.7897  -12.8033
BOND        30
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    5   9 1
            11    1  10 1 #Up
            12   10  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16   14  15 1
            17   11  15 2
            18   12  16 2
            19   16  17 1
            20   17  18 2
            21   18  19 1
            22   13  19 2
            23    6  20 2
            24    3  21 2
            25   15  22 1
            26   22  23 1
            27   23  24 2
            28   24  25 1
            29   24  26 1
            30   18  27 1

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