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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
[(3aR,4S,9aS,9bR)-9-(hydroxymethyl)-6-methyl-3-methylidene-2,7-dioxo-4,5,9a,9b-tetrahydro-3aH-azuleno[4,5-b]furan-4-yl] acetate
|
318.32
|
-0.1
|
1
|
6
|
89.9
|
3
|
|
|
(4aR,5S,6R,8aR)-5-[2-(furan-3-yl)ethyl]-5,6,8a-trimethyl-4a,6,7,8-tetrahydronaphthalene-1-carboxylic acid
|
314.40
|
5.4
|
1
|
3
|
50.44
|
4
|
|
|
(3S,4aR,6aR,6aR,6bR,12aR,14aR,14bR)-4,4,6a,6b,10,10,12a,14b-octamethyl-1,2,3,4a,5,6,6a,7,9,11,12,13,14,14a-tetradecahydropicen-3-ol
|
426.70
|
9.1
|
1
|
1
|
20.23
|
0
|
|
|
Hexadecanoic acid, 2-(2,3-dihydro-2-(hydroxymethyl)-2,4,6-trimethyl-3-oxo-1H-inden-5-yl)ethyl ester, (-)-
|
486.70
|
10.1
|
1
|
4
|
63.6
|
19
|
|
|
(Oxiran-2-yl)methyl decanoate
|
228.33
|
3.9
|
0
|
3
|
38.83
|
11
|
|
|
9-methoxy-11aH-[1]benzofuro[3,2-c]chromen-3-ol
|
268.26
|
2.4
|
1
|
4
|
47.92
|
1
|
|
|
12,13-Dihydroxy-11-methyl-6-methylidene-4,16-dioxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9-carboxylic acid
|
362.40
|
-0.8
|
3
|
7
|
121.13
|
1
|
|
|
16,17-Dihydroxy-11-methyl-6-methylidene-12-oxo-13-oxapentacyclo[9.3.3.15,8.01,10.02,8]octadecane-9-carboxylic acid
|
362.40
|
1.1
|
3
|
6
|
104.06
|
1
|
|
|
5,12-Dihydroxy-4-methyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadecane-2,4,8-tricarboxylic acid
|
394.40
|
0.1
|
5
|
8
|
152.36
|
3
|
|
|
Gibberellin A30
|
346.40
|
0.3
|
3
|
6
|
104.06
|
1
|
|
|
4,5,7,12-Tetrahydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadec-13-ene-9-carboxylic acid
|
378.40
|
-1.8
|
5
|
8
|
144.52
|
1
|
|
|
12,13-Dihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9-carboxylic acid
|
348.40
|
0.7
|
3
|
6
|
104.06
|
1
|
|
|
5,17-Dihydroxy-11-methyl-6-methylidene-12-oxo-13-oxapentacyclo[9.3.3.15,8.01,10.02,8]octadecane-9-carboxylic acid
|
362.40
|
0.5
|
3
|
6
|
104.06
|
1
|
|
|
5,11-Dihydroxy-4-methyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadecane-2,4,8-tricarboxylic acid
|
394.40
|
0.3
|
5
|
8
|
152.36
|
3
|
|
|
5,6-Dihydroxy-4-methyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadecane-2,4,8-tricarboxylic acid
|
394.40
|
0.8
|
5
|
8
|
152.36
|
3
|
|
|
14-Hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadec-12-ene-9-carboxylic acid
|
330.40
|
1.6
|
2
|
5
|
83.83
|
1
|
|
|
17-Hydroxy-4-methyl-14-methylidene-5-oxo-6-oxapentacyclo[11.2.1.14,7.01,10.03,9]heptadec-8-ene-2-carboxylic acid
|
330.40
|
1.1
|
2
|
5
|
83.83
|
1
|
|
|
1,3,8-Trihydroxy-7-methoxyxanthone
|
274.22
|
2.4
|
3
|
6
|
100.13
|
1
|
|
|
[(2S,3S,4R,5R)-2-[(2R,3R,4S,5S,6R)-3-acetyloxy-6-(acetyloxymethyl)-4,5-dihydroxyoxan-2-yl]oxy-2-(acetyloxymethyl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
|
614.50
|
-1
|
5
|
16
|
234.04
|
15
|
|
|
8-Prenyldaidzein
|
322.40
|
4.4
|
2
|
4
|
70.67
|
3
|
|
|
Pinostrobin 5-glucoside
|
432.40
|
0.7
|
4
|
9
|
134.91
|
5
|
|
|
(2E,8E)-pentadeca-2,8-dien-4,6-diyne-1,10-diol
|
232.32
|
3
|
2
|
2
|
40.46
|
7
|
|
|
(2E,8E)-10-hydroxypentadeca-2,8-dien-4,6-diynal
|
230.30
|
3.1
|
1
|
2
|
37.3
|
7
|
|
|
[(2E,9E)-pentadeca-2,9-dien-4,6-diynyl] acetate
|
258.35
|
4.8
|
0
|
2
|
26.3
|
9
|
|
|
(2Z,9Z)-pentadeca-2,9-dien-4,6-diyn-1-ol
|
216.32
|
4.2
|
1
|
1
|
20.23
|
7
|
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