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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
6-O-trans-Feruloylcatalpol
|
538.50
|
-0.9
|
6
|
13
|
197.13
|
9
|
|
|
(3,4-Disinapoyl)fructofuranosyl-(6-sinapoyl)glucopyranoside
|
960.90
|
1.2
|
8
|
23
|
323.81
|
23
|
|
|
Inerminoside B
|
674.70
|
-1.1
|
8
|
16
|
251.36
|
14
|
|
|
Sophorotriose
|
504.40
|
-5.8
|
11
|
16
|
268.68
|
7
|
|
|
4-Methoxycinnamic acid
|
178.18
|
1.8
|
1
|
3
|
46.53
|
3
|
|
|
1,2,7-Trihydroxy-6,8-dimethoxy-3-methylanthraqu inone
|
330.29
|
2.7
|
3
|
7
|
113.29
|
2
|
|
|
(2s)-5,6,7,2',3',4',5'-Heptamethoxyflavanone
|
434.40
|
2.7
|
0
|
9
|
90.91
|
8
|
|
|
3-[3,4-Dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)chromen-4-one
|
448.40
|
1.3
|
6
|
11
|
179.28
|
5
|
|
|
3-[(2S,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one
|
418.30
|
1.3
|
6
|
10
|
170.05
|
4
|
|
|
Isorhamnetin 3-galactoside
|
478.40
|
0.7
|
7
|
12
|
199.51
|
5
|
|
|
5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
|
478.40
|
0.7
|
7
|
12
|
199.51
|
5
|
|
|
5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-[(2S,3R,4R,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
|
478.40
|
0.7
|
7
|
12
|
199.51
|
5
|
|
|
Methyl 18-hydroxyoctadecanoate
|
314.50
|
6.9
|
1
|
3
|
46.53
|
18
|
|
|
Cyclododecanone
|
182.30
|
4.2
|
0
|
1
|
17.07
|
0
|
|
|
beta-D-Glucopyranosiduronic acid,(3beta,4alpha)-17-carboxy-23-hydroxy-28-norolean-12-en-3-yl 3-O-((1S,2S)-2-carboxy-1-(carboxymethoxy)-2-hydroxyethyl)-
|
810.90
|
4
|
8
|
16
|
267.04
|
12
|
|
|
beta-D-Glucopyranosiduronic acid, (3beta)-28-(beta-D-glucopyranosyloxy)-28-oxo-30-noroleana-12,20(29)-dien-3-yl 3-O-((1S,2S)-2-carboxy-1-(carboxymethoxy)-2-hydroxyethyl)-
|
941.00
|
2.1
|
10
|
20
|
325.96
|
14
|
|
|
Pikuroside
|
530.50
|
-2
|
7
|
14
|
214.06
|
7
|
|
|
Depressoside C
|
781.00
|
3.8
|
8
|
13
|
207.99
|
9
|
|
|
Depressoside D
|
799.00
|
2.8
|
9
|
14
|
228.22
|
8
|
|
|
1-18:2-2-18:2-Digalactosyldiacylglycerol
|
941.20
|
9.2
|
7
|
15
|
231.13
|
40
|
|
|
(1S,2S,5R,6R,10R,11R,12S,14S)-5-[(1S)-1-[(1S,3R,5S)-1-ethyl-5,6,6-trimethyl-2,7,8-trioxabicyclo[3.2.1]octan-3-yl]ethyl]-6,10-dimethylspiro[13-oxatetracyclo[7.5.0.02,6.012,14]tetradec-8-ene-11,5'-oxolane]-2',7-dione
|
514.60
|
3.8
|
0
|
7
|
83.59
|
3
|
|
|
(2R,3R)-2-[(3aS,3bS,8aS)-3-[(2R,3R)-3,4-Dihydro-3,5,7-trihydroxy-2H-1-benzopyran-2-yl]-3a,6,8,8a-tetrahydro-5,7,8a-trihydroxy-1,6,8-trioxocyclopent[a]inden-3b(1H)-yl]-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl 3,4,5-trihydroxybenzoate
|
760.60
|
1.4
|
11
|
18
|
318.5
|
5
|
|
|
Giffonin T
|
344.40
|
1
|
5
|
6
|
118.22
|
0
|
|
|
(9R,10R,11R,12R)-3,9,10,11,12,17-hexahydroxytricyclo[12.3.1.12,6]nonadeca-1(17),2,4,6(19),14(18),15-hexaen-8-one
|
360.40
|
0.1
|
6
|
7
|
138.45
|
0
|
|
|
(1R,2S,7S,10R,11R,13R,15R,16R,19S)-1,2-dihydroxy-7-[(2R,4R,5S,6R)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-10,15,19-trimethyl-14-oxapentacyclo[11.5.1.02,11.05,10.016,19]nonadec-4-en-12-one
|
506.60
|
1.3
|
3
|
8
|
114.68
|
3
|
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