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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
Sterculynic acid
|
290.40
|
5.5
|
1
|
2
|
37.3
|
14
|
|
|
3-[(6-deoxy-3-O-methylhexopyranosyl)oxy]-14,16-dihydroxycard-20(22)-enolide
|
550.70
|
1.3
|
4
|
9
|
134.91
|
4
|
|
|
17-Ethyl-3-methyl-3,15,20-triazapentacyclo[10.7.1.02,10.04,9.013,18]icosa-2(10),4,6,8,13(18),14,16-heptaene
|
303.40
|
2.8
|
1
|
2
|
29.85
|
1
|
|
|
Sudachitin
|
360.30
|
2.6
|
3
|
8
|
118.59
|
4
|
|
|
Sugeonol
|
234.33
|
2.1
|
1
|
2
|
37.3
|
0
|
|
|
Sugiresinol
|
286.32
|
2.2
|
3
|
4
|
69.92
|
2
|
|
|
Sumaresinol
|
472.70
|
6.1
|
3
|
4
|
77.76
|
1
|
|
|
(4R,4aR)-4-ethenyl-4a-hydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4,5,6-tetrahydropyrano[3,4-c]pyran-8-one
|
374.34
|
-2
|
5
|
10
|
155.14
|
4
|
|
|
(3R,4S,4aR)-4-ethenyl-4a-hydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4,5,6-tetrahydropyrano[3,4-c]pyran-8-one
|
374.34
|
-2
|
5
|
10
|
155.14
|
4
|
|
|
1,2-Dihydroxy-6,8-dimethoxy-xanthone
|
288.25
|
2.7
|
2
|
6
|
89.13
|
2
|
|
|
Methyl 2-[6-(furan-3-yl)-14-hydroxy-1,5,15,15-tetramethyl-8,17-dioxo-7-oxatetracyclo[11.3.1.02,11.05,10]heptadec-10-en-16-yl]-2-hydroxyacetate
|
486.60
|
1.7
|
2
|
8
|
123.27
|
4
|
|
|
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenoxy]oxane-3,4,5-triol
|
372.40
|
-1.3
|
5
|
9
|
138.07
|
7
|
|
|
methyl (1R,12S,19S)-12-ethyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,9,13-pentaene-10-carboxylate
|
336.40
|
3.4
|
1
|
4
|
41.57
|
3
|
|
|
2-(3-Hydroxy-4-methoxyphenyl)-3-(beta-D-glucopyranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one
|
478.40
|
0.7
|
7
|
12
|
199.51
|
5
|
|
|
Tamarixin
|
478.40
|
0.7
|
7
|
12
|
199.51
|
5
|
|
|
(3aS,6E,9R,10E,11aR)-9-hydroxy-6,10-dimethyl-3-methylidene-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-2-one
|
248.32
|
1
|
1
|
3
|
46.53
|
0
|
|
|
Hanphyllin
|
248.32
|
1
|
1
|
3
|
46.53
|
0
|
|
|
(3S,4R,4aR,5S,6R,6aR,6bR,8S,8aS,12aS,14aR,14bR)-4,8a-bis(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,5,6,8-tetrol
|
506.70
|
4
|
6
|
6
|
121.38
|
2
|
|
|
Isotaraxerol
|
426.70
|
9.3
|
1
|
1
|
20.23
|
0
|
|
|
Tasmanone
|
252.31
|
2.2
|
0
|
4
|
60.44
|
3
|
|
|
4-Epivulgarin
|
264.32
|
1.2
|
1
|
4
|
63.6
|
0
|
|
|
Tauremisin
|
264.32
|
1.2
|
1
|
4
|
63.6
|
0
|
|
|
(1S,2S,3R,5S,8R,9R,10R)-1,2,5,9,10-pentahydroxy-8,12,15,15-tetramethyl-4-methylidenetricyclo[9.3.1.03,8]pentadec-11-en-13-one
|
366.40
|
-1
|
5
|
6
|
118.22
|
0
|
|
|
(3R,3aS,6S,7aS)-3a-[6-(hydroxymethyl)-1,3-benzodioxol-5-yl]-6-methoxy-1-methyl-3,6,7,7a-tetrahydro-2H-indol-3-ol
|
333.40
|
0.8
|
2
|
6
|
71.39
|
3
|
|
|
methyl (4R,5E,6S)-5-ethylidene-4-[2-oxo-2-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[2-(4-hydroxyphenyl)ethoxy]oxan-2-yl]methoxy]ethyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate
|
686.70
|
-2.2
|
8
|
17
|
260.59
|
14
|
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