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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
10-Methoxy-6,6,14,14-tetramethyl-7-oxapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2,4,8,10,12,15(20),16,18-nonaene-16,17-diol
|
388.50
|
5
|
2
|
4
|
58.92
|
1
|
|
|
Maesopsin
|
288.25
|
2.2
|
4
|
6
|
107.22
|
2
|
|
|
3-[(1S,4R,5R,6R,8S,9R)-9-hydroxy-9-(hydroxymethyl)-5-methyl-4-prop-1-en-2-yl-5-tricyclo[6.2.2.01,6]dodecanyl]propanoic acid
|
336.50
|
3.4
|
3
|
4
|
77.76
|
5
|
|
|
3-[(1R,4R,5R,6S,8S)-9-(hydroxymethyl)-5-methyl-4-prop-1-en-2-yl-5-tricyclo[6.2.2.01,6]dodec-9-enyl]propanoic acid
|
318.40
|
4.2
|
2
|
3
|
57.53
|
5
|
|
|
3-[(1S,4R,5R,6R,8S,9R)-9-hydroxy-5,9-dimethyl-4-prop-1-en-2-yl-5-tricyclo[6.2.2.01,6]dodecanyl]propanoic acid
|
320.50
|
4.5
|
2
|
3
|
57.53
|
4
|
|
|
3-[(1R,4R,5R,6R,8S,9S)-9-(hydroxymethyl)-5-methyl-4-prop-1-en-2-yl-5-tricyclo[6.2.2.01,6]dodecanyl]propanoic acid
|
320.50
|
4.8
|
2
|
3
|
57.53
|
5
|
|
|
(1S,6R,8R,11R,12S,13R,15S,16R,19R,20S,21R)-8,13,19-trihydroxy-20-(hydroxymethyl)-1,7,7,11,16,20-hexamethylpentacyclo[13.8.0.03,12.06,11.016,21]tricos-3-en-5-one
|
488.70
|
4.5
|
4
|
5
|
97.99
|
1
|
|
|
(1R,2S,4S,4aS,8aS)-4a,8,8-trimethyl-1,2,3,4,5,6,7,8a-octahydronaphthalene-1,2,4-triol
|
228.33
|
1.8
|
3
|
3
|
60.69
|
0
|
|
|
(1S,6R,8R,11S,12S,13R,15S,16R,19R,20S,21R)-20-(hydroxymethyl)-1,7,7,11,16,20-hexamethylpentacyclo[13.8.0.03,12.06,11.016,21]tricos-3-ene-8,13,19-triol
|
474.70
|
5.5
|
4
|
4
|
80.92
|
1
|
|
|
Oubatchensine
|
355.30
|
2.5
|
1
|
7
|
85.3
|
1
|
|
|
Turrapubesin B
|
611.70
|
2.4
|
1
|
10
|
154.67
|
10
|
|
|
Turrapubesin A
|
591.10
|
2.7
|
1
|
9
|
129.34
|
10
|
|
|
[(1S,3S,4aR,5S,6R,6aR,10aS,10bS)-6-benzoyloxy-5-hydroxy-4a,6a,7,10b-tetramethyl-2'-oxospiro[2,5,6,9,10,10a-hexahydro-1H-benzo[f]chromene-3,4'-oxolane]-1-yl] benzoate
|
574.70
|
5.2
|
1
|
8
|
108.36
|
6
|
|
|
3-[(E)-2-[(1R,2R,3S,4R,4aR,8aS)-2,3,4-trihydroxy-1,2,4a,5-tetramethyl-4,7,8,8a-tetrahydro-3H-naphthalen-1-yl]ethenyl]-2H-furan-5-one
|
348.40
|
1.3
|
3
|
5
|
86.99
|
2
|
|
|
[(1S,3S,4aR,5S,6R,6aR,10aS,10bS)-5-benzoyloxy-1-hydroxy-4a,6a,10b-trimethyl-7-methylidene-2'-oxospiro[1,2,5,6,8,9,10,10a-octahydrobenzo[f]chromene-3,4'-oxolane]-6-yl] benzoate
|
574.70
|
5.4
|
1
|
8
|
108.36
|
6
|
|
|
Scutebarbatine B
|
557.60
|
4.7
|
1
|
8
|
112.02
|
8
|
|
|
phyllostachysin F
|
334.40
|
2.4
|
3
|
4
|
77.76
|
0
|
|
|
phyllostachysin H
|
334.40
|
2
|
3
|
4
|
77.76
|
0
|
|
|
phyllostachysin D
|
348.40
|
1.6
|
3
|
5
|
94.83
|
0
|
|
|
(1R,2S,4R,9R,10S,11S,13S,16R)-2,11,16-trihydroxy-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-8,15-dione
|
348.40
|
0.6
|
3
|
5
|
94.83
|
0
|
|
|
(2S)-2-(1,3-benzodioxol-5-yl)-8,8-dimethyl-6-(3-methylbut-2-enyl)-2,3-dihydropyrano[2,3-h]chromen-4-one
|
418.50
|
5.6
|
0
|
5
|
53.99
|
3
|
|
|
[(2S,9R,10R)-9-acetyloxy-8,8-dimethyl-4-oxo-2-phenyl-2,3,9,10-tetrahydropyrano[2,3-f]chromen-10-yl] acetate
|
424.40
|
2.9
|
0
|
7
|
88.13
|
5
|
|
|
7-(1,3-Benzodioxol-5-yl)-4-hydroxyfuro[3,2-g]chromen-5-one
|
322.30
|
3.6
|
1
|
6
|
82.04
|
1
|
|
|
2-(3,4-dihydroxyphenyl)-8-[(2E)-3,7-dimethylocta-2,6-dienyl]-7-hydroxychromen-4-one
|
406.50
|
5.9
|
3
|
5
|
90.9
|
6
|
|
|
(9E,13Z)-pentadeca-9,13-dien-11-yne-2,8-dione
|
232.32
|
2.7
|
0
|
2
|
34.14
|
7
|
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