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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
Meconic acid
|
200.10
|
0
|
3
|
7
|
125.04
|
2
|
|
|
1-hydroxy-2-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxyanthracene-9,10-dione
|
534.50
|
-1.2
|
7
|
13
|
212.67
|
5
|
|
|
(9R)-9'-hydroxylariciresinol tetraacetate
|
544.50
|
3.2
|
0
|
11
|
132.89
|
14
|
|
|
Schizotenuin F
|
552.50
|
4
|
6
|
12
|
200.28
|
12
|
|
|
[(3S,4R,5S)-5-[[9-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-1-oxo-3H-benzo[f]isobenzofuran-4-yl]oxy]-3,4-dihydroxy-tetrahydrofuran-3-yl]methyl acetate
|
554.50
|
2.2
|
2
|
12
|
148.44
|
8
|
|
|
(2S,3R)-3-[(2S,3R)-5,7-dihydroxy-2-(4-methoxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one
|
556.50
|
5
|
5
|
10
|
162.98
|
4
|
|
|
Woorenoside I
|
564.60
|
0.6
|
5
|
12
|
165.76
|
11
|
|
|
(3S,6S)-2-(hydroxymethyl)-6-(4-hydroxyphenoxy)oxane-3,4,5-triol
|
272.25
|
-0.7
|
5
|
7
|
119.61
|
3
|
|
|
10b-[3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-8-yl]-1,3,8-trihydroxy-5aH-[1]benzofuro[2,3-b]chromen-11-one
|
570.50
|
4.3
|
7
|
12
|
207.35
|
2
|
|
|
Dipiperamide A
|
570.70
|
4.8
|
0
|
6
|
77.54
|
6
|
|
|
(2R)-3-[[(2S)-3-(3-chloro-4-methoxyphenyl)-2-[[(E,5S,6S,7R,8S)-5,7,8-trihydroxy-6-methyl-8-phenyloct-2-enoyl]amino]propanoyl]amino]-2-methylpropanoic acid
|
577.10
|
2.7
|
6
|
8
|
165.42
|
15
|
|
|
rollidecin C
|
578.90
|
9.8
|
2
|
6
|
85.22
|
23
|
|
|
Actephilol A
|
580.60
|
7.2
|
3
|
8
|
114.68
|
2
|
|
|
Epi-actephilol A
|
580.60
|
7.2
|
3
|
8
|
114.68
|
2
|
|
|
(2R,3R,4S,5S,6R)-2-[[(1R,2R,3R)-7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-6,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
582.60
|
0.4
|
7
|
13
|
196.99
|
10
|
|
|
Epicalyxin K
|
582.60
|
5.8
|
4
|
8
|
125.68
|
7
|
|
|
cylindrocyclophane A
|
584.80
|
10.2
|
6
|
6
|
121.38
|
6
|
|
|
[(1S,2R,5S,6S,8R,10R,11S,12R,14R,15R,16S,19S,21R)-21-acetyloxy-6-(furan-3-yl)-12,19-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.01,14.02,11.05,10.08,10]henicosan-16-yl] 2-methylpropanoate
|
586.70
|
2.3
|
2
|
10
|
145.03
|
6
|
|
|
2,3,5-Tribromo-6-(3,5-dibromo-2-hydroxyphenoxy)phenol
|
596.70
|
6.2
|
2
|
3
|
49.69
|
2
|
|
|
(2S)-4-[(13R)-13-hydroxy-13-[(2R,5S)-5-[(2S,5R)-5-[(1R)-1-hydroxyundecyl]oxolan-2-yl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one
|
606.90
|
11.2
|
2
|
6
|
85.22
|
25
|
|
|
ligurobustoside E
|
608.70
|
2
|
6
|
12
|
184.6
|
13
|
|
|
Garcilivin A
|
620.60
|
7.3
|
6
|
10
|
181.8
|
3
|
|
|
Insularine
|
620.70
|
6.2
|
0
|
8
|
61.86
|
3
|
|
|
Quercetin 3,7,3',4'-tetra-O-sulfate
|
622.50
|
-0.2
|
5
|
19
|
338.36
|
9
|
|
|
Ligurobustoside O
|
622.70
|
0.6
|
6
|
13
|
201.67
|
14
|
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