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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
17-acetoxyjolkinolide B
|
388.50
|
2.5
|
0
|
6
|
77.66
|
3
|
|
|
Sagittine B
|
420.60
|
4.6
|
3
|
5
|
79.15
|
5
|
|
|
chloranthalactone E 8-O-beta-D-glucopyranoside
|
424.40
|
-1.2
|
5
|
9
|
145.91
|
3
|
|
|
Malonganenone A
|
438.60
|
5.9
|
0
|
3
|
69.78
|
12
|
|
|
Dimethyl selenide
|
109.04
|
|
0
|
0
|
0
|
0
|
|
|
(2S)-2-[2,2-dimethyl-8-(3-methylbut-2-enyl)-3,4-dihydrochromen-6-yl]-7-hydroxy-8-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one
|
460.60
|
7.4
|
1
|
4
|
55.76
|
5
|
|
|
[(2S,3R,4S,5S,6R)-2,4,5-trihydroxy-6-[[2-(1-hydroxy-4-oxocyclohexa-2,5-dien-1-yl)acetyl]oxymethyl]oxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
|
476.40
|
-0.2
|
5
|
11
|
180.05
|
9
|
|
|
kadlongilactone A
|
494.60
|
2.5
|
2
|
6
|
93.06
|
0
|
|
|
[(9S,10R,11R)-11-hydroxy-4,5,14,15,16-pentamethoxy-9,10-dimethyl-3-tricyclo[10.4.0.02,7]hexadeca-1(16),2,4,6,12,14-hexaenyl] (Z)-2-methylbut-2-enoate
|
500.60
|
5.1
|
1
|
8
|
92.68
|
8
|
|
|
longipedlactoneH
|
512.60
|
2.6
|
3
|
7
|
113.29
|
2
|
|
|
Lancifodilactone N
|
542.60
|
0.7
|
1
|
10
|
134.66
|
0
|
|
|
6-[5-(5,7-Dihydroxy-4-oxochromen-2-yl)-2-methoxyphenyl]-5,7-dihydroxy-2-(4-methoxyphenyl)chromen-4-one
|
566.50
|
5.7
|
4
|
10
|
159.8
|
5
|
|
|
(2R,3R)-2-(3,4-dihydroxyphenyl)-6-[(2R,3S,4S)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol
|
578.50
|
2.4
|
10
|
12
|
220.76
|
3
|
|
|
15-O-deacetylnimbolidin B
|
656.80
|
3.5
|
1
|
11
|
147.8
|
12
|
|
|
[(4aS,9S,10R,10aS)-6-acetyloxy-10-[[(4bS,8aS)-4b,8,8-trimethyl-2-propan-2-yl-5,6,7,8a-tetrahydrophenanthren-3-yl]oxy]-1,1,4a-trimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-9-yl] acetate
|
668.90
|
12.4
|
0
|
5
|
61.83
|
8
|
|
|
5,7-dihydroxy-8-[5-[5-hydroxy-4-oxo-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-yl]-2-methoxyphenyl]-2-(4-methoxyphenyl)chromen-4-one
|
728.60
|
3.9
|
7
|
15
|
238.95
|
8
|
|
|
Pulsatilla saponin D
|
913.10
|
2
|
10
|
17
|
274.75
|
9
|
|
|
[(1S,2S,3'S,4S,4'R,5'R,6S,7S,8R,9S,12S,13R,14R,16R)-16-[(2R,3R,4R,5R,6R)-5-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-3',4'-dihydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-14-yl] acetate
|
975.10
|
-1
|
11
|
21
|
322.67
|
10
|
|
|
Cycloleonuripeptide F
|
1032.20
|
3.9
|
7
|
11
|
267.2
|
8
|
|
|
Gymnoside IX
|
1061.00
|
0.6
|
10
|
24
|
362.88
|
26
|
|
|
(-)-Elema-1,3,11(13)-trien-12-al
|
218.33
|
4.7
|
0
|
1
|
17.07
|
4
|
|
|
(4aS,6R,8aS)-4a-hydroxy-4,8a-dimethyl-6-prop-1-en-2-yl-5,6,7,8-tetrahydro-1H-naphthalen-2-one
|
234.33
|
2.4
|
1
|
2
|
37.3
|
1
|
|
|
(4R,4aS,6S,8S)-8-hydroxy-4,4a-dimethyl-6-prop-1-en-2-yl-3,4,5,6,7,8-hexahydronaphthalen-2-one
|
234.33
|
2.6
|
1
|
2
|
37.3
|
1
|
|
|
(2E,4Z)-N-(2-methylpropyl)dodeca-2,4-dien-8,10-diynamide
|
243.34
|
3.7
|
1
|
1
|
29.1
|
7
|
|
|
Oleocanthal
|
304.34
|
1.5
|
1
|
5
|
80.67
|
10
|
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