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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
erythro-Guaiacylglycerol |A-dihydroconiferyl ether
|
378.40
|
1.6
|
4
|
7
|
108.61
|
10
|
|
|
Threo-1-(4-hydroxy-3-methoxyphenyl)-2-(4-(3-hydroxypropyl)-2-methoxyphenoxy)-1,3-propanediol
|
378.40
|
1.6
|
4
|
7
|
108.61
|
10
|
|
|
(3S,3aS,6E,9S,10E,11aS)-3,10-dimethyl-2-oxo-9-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-6-carbaldehyde
|
426.50
|
-0.5
|
4
|
9
|
142.75
|
4
|
|
|
Lactuside C
|
424.40
|
-1.1
|
4
|
9
|
142.75
|
3
|
|
|
Dammara-20,24-dien-3 beta-ol
|
426.70
|
10
|
1
|
1
|
20.23
|
4
|
|
|
Dammaradienol
|
426.70
|
10
|
1
|
1
|
20.23
|
4
|
|
|
(1S,2R,4aS,6aS,6bR,12aR,12bR,14bS)-1,2,6a,6b,9,9,12a-heptamethyl-10-oxo-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid
|
454.70
|
7
|
1
|
3
|
54.37
|
1
|
|
|
6Beta,7Alpha-Dihydroxyroyleanone
|
348.40
|
2.2
|
3
|
5
|
94.83
|
1
|
|
|
(1S,2E,6E,10R)-3,7,11,11-tetramethylbicyclo[8.1.0]undeca-2,6-diene
|
204.35
|
4.1
|
0
|
0
|
0
|
0
|
|
|
(1S,2Z,6E,10S)-3,7,11,11-tetramethylbicyclo[8.1.0]undeca-2,6-diene
|
204.35
|
4.1
|
0
|
0
|
0
|
0
|
|
|
Bicyclogermacrene
|
204.35
|
4.1
|
0
|
0
|
0
|
0
|
|
|
Isolepidozene
|
204.35
|
4.1
|
0
|
0
|
0
|
0
|
|
|
6,8,9,10'-Tetrahydroxy-1',6,6',9,10'-pentamethylspiro[3a,4,5,8,9a,9b-hexahydroazuleno[4,5-b]furan-3,13'-4-oxatetracyclo[10.2.1.02,11.03,7]pentadec-2(11)-ene]-2,5'-dione
|
528.60
|
-0.1
|
4
|
8
|
133.52
|
0
|
|
|
gamma-Glutamyl-S-methylcysteine sulfoxide
|
280.30
|
-5
|
4
|
8
|
166
|
8
|
|
|
N-gamma-L-Glutamyl-L-methionine
|
278.33
|
-3.1
|
4
|
7
|
155.02
|
9
|
|
|
gamma-L-Glutamyl-L-methionine sulfoxide
|
294.33
|
-4.7
|
4
|
8
|
166
|
9
|
|
|
O-methylepivincanol
|
310.40
|
3.5
|
0
|
2
|
17.4
|
2
|
|
|
(15R,17R,19R)-15-ethyl-17-methoxy-1,11-diazapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2,4,6,8(18)-tetraene
|
310.40
|
3.5
|
0
|
2
|
17.4
|
2
|
|
|
(15R,17S,19R)-15-ethyl-17-methoxy-1,11-diazapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2,4,6,8(18)-tetraene
|
310.40
|
3.5
|
0
|
2
|
17.4
|
2
|
|
|
1,2,10-trimethoxy-6-methyl-6-oxido-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium-11-ol
|
357.40
|
2.5
|
1
|
5
|
70.98
|
3
|
|
|
(-)-Caryachine
|
325.40
|
2.8
|
1
|
5
|
51.16
|
1
|
|
|
[(1S,2R,4R,7E,10R,11R)-4,8-dimethyl-12-methylidene-13-oxo-3,14-dioxatricyclo[9.3.0.02,4]tetradec-7-en-10-yl] (Z)-2-methylbut-2-enoate
|
346.40
|
1.9
|
0
|
5
|
65.13
|
3
|
|
|
2-[(3aR,4R,6S,7R,7aR)-6-ethenyl-6-methyl-4-[(E)-2-methylbut-2-enoyl]oxy-3-methylidene-2-oxo-4,5,7,7a-tetrahydro-3aH-1-benzofuran-7-yl]prop-2-enoic acid
|
360.40
|
3.6
|
1
|
6
|
89.9
|
6
|
|
|
[(3aS,6E,9S,10E,11aR)-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-9-yl] acetate
|
290.40
|
1.6
|
0
|
4
|
52.6
|
2
|
|
|
8-Desoxycumambrin b
|
248.32
|
1.8
|
1
|
3
|
46.53
|
0
|
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