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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
(1R,2R,5S,6S,7S,8R,11S)-2-[(1R)-1-hydroxyethyl]-1'-methoxy-4-methylspiro[9-oxa-4-azatetracyclo[6.3.1.02,6.05,11]dodecane-7,3'-indole]-2'-one
|
370.40
|
1
|
1
|
5
|
62.24
|
2
|
|
|
(1R,2R,5S,6S,7S,8R,11S)-2-[(1S)-1-hydroxyethyl]-1'-methoxy-4-methylspiro[9-oxa-4-azatetracyclo[6.3.1.02,6.05,11]dodecane-7,3'-indole]-2'-one
|
370.40
|
1
|
1
|
5
|
62.24
|
2
|
|
|
3-(4-Hydroxy-4-methylpentyl)furan
|
168.23
|
1.9
|
1
|
2
|
33.37
|
4
|
|
|
3,8-dimethyl-5-propan-2-yl-4,4a,5,6,7,8-hexahydro-3H-naphthalen-2-one
|
220.35
|
3.8
|
0
|
1
|
17.07
|
1
|
|
|
1,6-Dimethyl-4-(propan-2-yl)-1,2,3,4,4a,5-hexahydronaphthalene
|
204.35
|
4.5
|
0
|
0
|
0
|
1
|
|
|
[(1S,3S,4aS,6S,6aR,7S,10aS,10bS)-1-acetyloxy-4a,6a,7,10b-tetramethyl-2',8-dioxospiro[1,2,5,6,7,9,10,10a-octahydrobenzo[f]chromene-3,4'-oxolane]-6-yl] benzoate
|
512.60
|
3.6
|
0
|
8
|
105.2
|
5
|
|
|
Licoflavanone
|
340.40
|
4.3
|
3
|
5
|
86.99
|
3
|
|
|
(S)-5,7-Dihydroxy-2-(4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl)chroman-4-one
|
340.40
|
4.3
|
3
|
5
|
86.99
|
3
|
|
|
(1S,2R,6S,7S,9S)-1,2,6-trimethyl-8-methylidenetricyclo[5.3.1.02,6]undecan-9-ol
|
220.35
|
3.7
|
1
|
1
|
20.23
|
0
|
|
|
(1S,2R,6S,7S)-1,2,6-trimethyl-8-methylidenetricyclo[5.3.1.02,6]undecan-9-one
|
218.33
|
4.1
|
0
|
1
|
17.07
|
0
|
|
|
(1S,2R,6S,7R,8R)-1,2,6,8-tetramethyltricyclo[5.3.1.02,6]undecan-9-one
|
220.35
|
4.2
|
0
|
1
|
17.07
|
0
|
|
|
Nb-Methyltetrahydroharmol
|
216.28
|
2
|
2
|
2
|
39.26
|
0
|
|
|
Argophyllin B
|
380.40
|
2.1
|
2
|
7
|
105.59
|
4
|
|
|
(9,10,13,15-Tetrahydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl)methyl acetate
|
422.50
|
-0.4
|
4
|
8
|
133.52
|
3
|
|
|
[(1S,2S,5R,8S,9S,10S,11R,12R,13S,15R)-9,10,13,15-tetrahydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate
|
422.50
|
-0.4
|
4
|
8
|
133.52
|
3
|
|
|
[(1R,2S,5R,8S,9S,10S,11S,12R,13S)-13-acetyloxy-9,10-dihydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl]methyl acetate
|
448.50
|
1.2
|
2
|
8
|
119.36
|
5
|
|
|
9alpha-Hydroxy-8,13-epoxy-labd-14-EN-11-one
|
320.50
|
3.7
|
1
|
3
|
46.53
|
1
|
|
|
[(3R,4aR,5S,6S,6aS,10aS,10bS)-3-ethenyl-6,10b-dihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-5-yl] acetate
|
394.50
|
2.3
|
2
|
6
|
93.06
|
3
|
|
|
(3R,4aR,6R,6aS,10aS,10bR)-3-ethenyl-6-hydroxy-3,4a,7,7,10a-pentamethyl-2,5,6,6a,8,9,10,10b-octahydrobenzo[f]chromen-1-one
|
320.50
|
3.7
|
1
|
3
|
46.53
|
1
|
|
|
11-Oxomanoyl oxide
|
304.50
|
4.7
|
0
|
2
|
26.3
|
1
|
|
|
2-Hydroxy-2,11-dimethyl-6-methylidene-8,12,13-trioxatetracyclo[9.2.2.01,10.05,9]pentadec-14-en-7-one
|
278.30
|
0.9
|
1
|
5
|
64.99
|
0
|
|
|
(1S,2R,5S,9S,10S,11S)-2-hydroxy-2,11-dimethyl-6-methylidene-8,12,13-trioxatetracyclo[9.2.2.01,10.05,9]pentadec-14-en-7-one
|
278.30
|
0.9
|
1
|
5
|
64.99
|
0
|
|
|
(1S,2R,5S,9S,10S,11R)-2-hydroxy-2,11-dimethyl-6-methylidene-8,12,13-trioxatetracyclo[9.2.2.01,10.05,9]pentadec-14-en-7-one
|
278.30
|
0.9
|
1
|
5
|
64.99
|
0
|
|
|
Lansiol
|
468.80
|
10.6
|
1
|
1
|
20.23
|
5
|
|
|
DL-Methionine methylsulfonium chloride
|
199.70
|
|
2
|
4
|
63.32
|
4
|
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