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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
(9S)-3,5,9-trimethyl-6,7,8,9-tetrahydrobenzo[g][1]benzofuran
|
214.30
|
4.8
|
0
|
1
|
13.14
|
0
|
|
|
Farnesiferol C
|
382.50
|
5.5
|
0
|
4
|
48.67
|
6
|
|
|
3,7,11-trimethyl-(2Z,6E)-2,6,10-dodecatrienoic acid
|
236.35
|
5
|
1
|
2
|
37.3
|
7
|
|
|
(1S,9S)-4-hydroxy-5,13-dimethoxy-17-methyl-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2,4,6,10,13-pentaen-12-one
|
327.40
|
1.9
|
1
|
5
|
59
|
2
|
|
|
Flemingin B
|
422.50
|
5.7
|
4
|
6
|
107.22
|
6
|
|
|
Flemingin C
|
422.50
|
5.7
|
4
|
6
|
107.22
|
6
|
|
|
Forsythide
|
390.34
|
-1.8
|
6
|
11
|
183.21
|
5
|
|
|
Acacetin-7-O-neohesperidoside
|
592.50
|
0.1
|
7
|
14
|
217.97
|
7
|
|
|
Fragilin
|
318.71
|
3.7
|
2
|
5
|
83.83
|
1
|
|
|
7-hydroxy-6-methoxy-8-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one
|
370.31
|
-0.6
|
5
|
10
|
159.05
|
4
|
|
|
Friedelane
|
412.70
|
11.6
|
0
|
0
|
0
|
0
|
|
|
Epifriedelin
|
426.70
|
9.8
|
0
|
1
|
17.07
|
0
|
|
|
(4R,4aS,6aS,6aS,6bS,8aR,12aR,14aS,14bS)-4,4a,6a,6b,8a,11,11,14a-octamethyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one
|
426.70
|
9.8
|
0
|
1
|
17.07
|
0
|
|
|
Methyl 2-hexa-2,4-diynyl-6-methoxybenzoate
|
242.27
|
3.2
|
0
|
3
|
35.53
|
5
|
|
|
1-Deoxy-L-galactitol
|
166.17
|
-2
|
5
|
5
|
101.15
|
4
|
|
|
L(-)-Fucose
|
164.16
|
-2.4
|
4
|
5
|
97.99
|
4
|
|
|
Stigmastan-3beta-ol
|
416.70
|
10.2
|
1
|
1
|
20.23
|
6
|
|
|
(3S,5S,8S,9S,10S,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
|
416.70
|
10.2
|
1
|
1
|
20.23
|
6
|
|
|
methyl (1R,2R)-2-ethyl-2,5,7-trihydroxy-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate
|
396.40
|
3.6
|
3
|
7
|
121.13
|
3
|
|
|
2-(3,4-Dihydroxyphenyl)-7-hydroxy-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
|
448.40
|
0
|
7
|
11
|
190.28
|
4
|
|
|
7-(1,3-Benzodioxol-5-yl)-4-methoxyfuro[3,2-g]chromen-5-one
|
336.30
|
3.4
|
0
|
6
|
71.04
|
2
|
|
|
17,17-Dimethyl-5-(3-methylbut-2-enyl)-3,12,16-trioxapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1(13),4(9),5,7,14,18,20-heptaen-6-ol
|
390.50
|
5.5
|
1
|
4
|
47.92
|
2
|
|
|
(2R,10R)-17,17-dimethyl-5-(3-methylbut-2-enyl)-3,12,16-trioxapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1(13),4(9),5,7,14,18,20-heptaen-6-ol
|
390.50
|
5.5
|
1
|
4
|
47.92
|
2
|
|
|
Gentioside
|
552.50
|
-1.1
|
7
|
14
|
217.97
|
6
|
|
|
(1E,4Z)-germacrene B
|
204.35
|
4.1
|
0
|
0
|
0
|
0
|
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