KEGG   COMPOUND: C14892
Entry
C14892                      Compound                               
Name
17-Allylestra-1,3,5(10)-triene-3,17beta-diol
Formula
C21H28O2
Exact mass
312.2089
Mol weight
312.4458
Structure
Other DBs
PubChem: 17395890
ChEBI: 79419
NIKKAJI: J697.396E
LinkDB
KCF data

ATOM        23
            1   C1y C    24.4873  -16.5606
            2   C1y C    23.3060  -17.2390
            3   C1z C    24.4931  -15.2040
            4   C1x C    26.8321  -16.5898
            5   C1y C    22.1306  -16.5430
            6   C1x C    23.3060  -18.6014
            7   C1x C    23.3294  -14.5139
            8   C1z C    25.6801  -14.5373
            9   C1a C    24.4873  -13.8414
            10  C1x C    26.8498  -15.2331
            11  C8y C    20.9436  -17.2273
            12  C1x C    22.1423  -15.1863
            13  C1x C    22.1189  -19.2739
            14  O1a O    25.6044  -13.1690
            15  C8y C    20.9378  -18.5897
            16  C8x C    19.7624  -16.5430
            17  C8x C    19.7624  -19.2680
            18  C8x C    18.5870  -17.2273
            19  C8y C    18.5811  -18.5897
            20  O1a O    17.3940  -19.2680
            21  C1b C    26.9024  -13.8600
            22  C2b C    28.1149  -14.5600
            23  C2a C    29.3273  -13.8600
BOND        26
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     3   9 1 #Up
            9     4  10 1
            10    5  11 1
            11    5  12 1
            12    6  13 1
            13    8  14 1 #Up
            14   11  15 2
            15   11  16 1
            16   15  17 1
            17   16  18 2
            18   17  19 2
            19   19  20 1
            20    7  12 1
            21    8  10 1
            22   13  15 1
            23   18  19 1
            24    8  21 1 #Down
            25   21  22 1
            26   22  23 2

» Japanese version

DBGET integrated database retrieval system