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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
(2E)-3-[(2S,3S)-2-(3,4-Dimethoxyphenyl)-2,3-dihydro-7-methoxy-3-methyl-5-benzofuranyl]-2-propen-1-ol
|
356.40
|
3.5
|
1
|
5
|
57.15
|
6
|
|
|
Fragransol D
|
370.40
|
3.3
|
1
|
6
|
66.38
|
5
|
|
|
(1R,2S)-1-(3,4-dimethoxyphenyl)-2-[4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenoxy]propan-1-ol
|
404.50
|
2.8
|
2
|
7
|
86.61
|
10
|
|
|
16-Feruloyloxypalmitic acid
|
448.60
|
7.8
|
2
|
6
|
93.06
|
20
|
|
|
boeravinone A
|
326.30
|
2.9
|
2
|
6
|
89.13
|
1
|
|
|
boeravinone B
|
312.27
|
2.4
|
3
|
6
|
100.13
|
0
|
|
|
3-(2,4-Dimethoxyphenyl)-7-methoxy-4H-1-benzopyran-4-one
|
312.30
|
3.1
|
0
|
5
|
57.9
|
4
|
|
|
5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-3-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
|
492.40
|
1
|
6
|
12
|
188.51
|
6
|
|
|
Maximaisoflavone E
|
312.27
|
2.6
|
1
|
6
|
78.13
|
2
|
|
|
7,8-Dimethoxy-3',4'-methylenedioxyisoflavone
|
326.30
|
2.9
|
0
|
6
|
67.13
|
3
|
|
|
Egonol Acetate
|
368.40
|
4.3
|
0
|
6
|
67.13
|
7
|
|
|
2-[3-[2-(1,3-Benzodioxol-5-yl)-7-methoxy-1-benzofuran-5-yl]propoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
488.50
|
2.1
|
4
|
10
|
140.21
|
8
|
|
|
Magnoloside B
|
786.70
|
-2.1
|
12
|
20
|
324.44
|
14
|
|
|
Magnoloside C
|
948.90
|
-4.2
|
15
|
25
|
403.59
|
17
|
|
|
(2S,3S,4S)-4-(1,3-benzodioxol-5-ylmethyl)-3-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]oxolan-2-ol
|
386.40
|
3.4
|
1
|
7
|
75.61
|
5
|
|
|
(Z)-3-Hydroxy-5-methoxystilbene
|
226.27
|
3.8
|
1
|
2
|
29.46
|
3
|
|
|
(1S,4R,5S,8R,9S,12R,14R)-4,8,12-trimethyl-2,13-dioxatetracyclo[7.5.0.01,5.012,14]tetradecan-3-one
|
250.33
|
2.7
|
0
|
3
|
38.83
|
0
|
|
|
methyl (1S,2S,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylate
|
470.70
|
7.7
|
1
|
3
|
46.53
|
2
|
|
|
(1S,4S,4aR,6R,8aS)-4,8a-dimethyl-6-prop-1-en-2-yl-1,2,3,4,5,6,7,8-octahydronaphthalene-1,4a-diol
|
238.37
|
3.3
|
2
|
2
|
40.46
|
1
|
|
|
[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl] 1,10,11-trihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
|
650.80
|
3.2
|
7
|
10
|
177.14
|
4
|
|
|
kaji-ichigoside F1
|
650.80
|
3.2
|
7
|
10
|
177.14
|
4
|
|
|
10-[5-[4,5-Dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-3,4-dihydroxyoxan-2-yl]oxy-2-hydroxy-4,5,9,9,13,20-hexamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosane-20-carbaldehyde
|
899.10
|
0.5
|
9
|
17
|
263.75
|
8
|
|
|
Cyclopenta[c]pyran-1(3H)-one, 6-(beta-D-glucopyranosyloxy)hexahydro-4,7-dimethyl-, (4R,4aR,6R,7R,7aS)-
|
346.37
|
-0.4
|
4
|
8
|
125.68
|
3
|
|
|
4-[3-hydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]butan-2-one
|
342.34
|
-0.9
|
5
|
8
|
136.68
|
6
|
|
|
(3S,3aR,4S,6E,10E,11aR)-4-hydroxy-3,6,10-trimethyl-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-2-one
|
250.33
|
2
|
1
|
3
|
46.53
|
0
|
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