Try searching for...
Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
erythro-6,8-Dotriacontanediol
|
482.90
|
14.3
|
2
|
2
|
40.46
|
29
|
|
|
(1R,4S,5R,9S,10S,12R,13R,14S,16S)-16-hydroxy-5,9,13-trimethylpentacyclo[11.2.1.01,10.04,9.012,14]hexadecane-5-carboxylic acid
|
318.40
|
4.1
|
2
|
3
|
57.53
|
1
|
|
|
[(1S,3R)-1-[(2R)-3,3-dimethyloxiran-2-yl]-3-[(5R,8S,9S,10R,14R)-4,4,8,10,14-pentamethyl-3,16-dioxo-2,5,6,7,9,11,12,15-octahydro-1H-cyclopenta[a]phenanthren-17-yl]butyl] acetate
|
512.70
|
5.6
|
0
|
5
|
72.97
|
6
|
|
|
16(R)-(-)-kaura-2,12-dione
|
302.50
|
4
|
0
|
2
|
34.14
|
0
|
|
|
[(1S,3R)-3-[(5R,8S,9S,10S,11S,14R,16S)-11,16-dihydroxy-4,4,8,10,14-pentamethyl-3-oxo-1,2,5,6,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-1-[(2R)-3,3-dimethyloxiran-2-yl]butyl] acetate
|
530.70
|
4.1
|
2
|
6
|
96.36
|
6
|
|
|
(2S,3S,4S,5R,6R)-6-[[(3S,4aR,6aS,6bR,8aS,10R,11S,12aR,14bS)-11-carboxy-10-hydroxy-4,4,6a,6b,8a,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a-dodecahydropicen-3-yl]oxy]-5-[(2R,3R,4S,5S,6S)-6-carboxy-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid
|
969.10
|
2.8
|
11
|
20
|
329.12
|
9
|
|
|
(1S,2R,5S,6S,9S,11R,12S,13R)-6-(furan-3-yl)-13-hydroxy-5,12,16,16-tetramethyl-7,10,17-trioxahexacyclo[13.3.3.01,15.02,12.05,11.09,11]henicos-19-ene-8,14,21-trione
|
468.50
|
1.7
|
1
|
8
|
115.57
|
1
|
|
|
(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylhept-6-en-2-yl]-3-hydroxy-10,13-dimethyl-1,2,3,4,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-7-one
|
426.70
|
8.2
|
1
|
2
|
37.3
|
6
|
|
|
[(1S,2R,6S,7R,9R,11S,12S,14R,15R,16R)-14-acetyloxy-15-[(1S)-1-[(2R)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-6-hydroxy-2-methyl-3-oxo-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadec-4-en-16-yl]methyl acetate
|
570.70
|
2.9
|
1
|
9
|
128.73
|
7
|
|
|
[(1S,2R,6S,7R,9R,11S,12S,14R,15R,16S,17R)-17-acetyloxy-15-[(1S)-1-[(2R)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-6-hydroxy-2,16-dimethyl-3-oxo-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadec-4-en-14-yl] acetate
|
570.70
|
3
|
1
|
9
|
128.73
|
6
|
|
|
3-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)-7-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one
|
902.80
|
-3.8
|
14
|
24
|
387.27
|
11
|
|
|
(1R,7S,8S)-7-(hydroxymethyl)-1,2,3,5,6,8-hexahydropyrrolizine-1,7-diol
|
173.21
|
-1.5
|
3
|
4
|
63.93
|
1
|
|
|
(2S,3R,4S,5S,6R)-2-[[(1S,7S,7aS)-7-hydroxy-7-methyl-6,7a-dihydro-1H-cyclopenta[c]pyran-1-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
330.33
|
-1.6
|
5
|
8
|
128.84
|
3
|
|
|
(1S,4aS,5S,6S,7R,7aR)-6-chloro-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5,6,7,7a-tetrahydro-1H-cyclopenta[c]pyran-4a,5,7-triol
|
384.76
|
-3.2
|
7
|
10
|
169.3
|
3
|
|
|
(2S,3R,4S,5S,6R)-2-[[(1S,4aR,5R,7S,7aS)-5,7-dihydroxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
334.32
|
-2.4
|
6
|
9
|
149.07
|
3
|
|
|
(2S,3R,4S,5S,6R)-2-[[(1S,4aR,6S,7S,7aS)-6-hydroxy-7-(hydroxymethyl)-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
348.34
|
-1.6
|
6
|
9
|
149.07
|
4
|
|
|
(4R,5R)-1,5-bis(3,4-dihydroxyphenyl)-5-hydroxy-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentan-1-one
|
496.50
|
-0.9
|
9
|
12
|
217.6
|
9
|
|
|
(4R,5S)-1,5-bis(3,4-dihydroxyphenyl)-5-hydroxy-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentan-1-one
|
496.50
|
-0.9
|
9
|
12
|
217.6
|
9
|
|
|
(4R,5R)-1,5-bis(3,4-dihydroxyphenyl)-5-methoxy-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentan-1-one
|
510.50
|
-0.4
|
8
|
12
|
206.6
|
10
|
|
|
2-[5-Carboxy-4-(5-carboxy-2,3-dihydroxyphenoxy)-2,3-dihydroxyphenoxy]-3,4,5-trihydroxybenzoic acid
|
506.30
|
1.1
|
10
|
15
|
271.97
|
7
|
|
|
1,2,5,6-Tetrahydroxy-4-(2-methylbut-3-en-2-yl)-7-(3-methylbut-2-enyl)xanthen-9-one
|
396.40
|
6
|
4
|
6
|
111.13
|
4
|
|
|
(1R,5S,7R,13R,20R)-11-hydroxy-5,10,13,14,15-pentamethoxy-7,20-diphenyl-2,8,21-trioxapentacyclo[11.8.0.01,17.03,12.04,9]henicosa-3,9,11,14,17-pentaen-16-one
|
614.60
|
3.8
|
1
|
10
|
111.14
|
7
|
|
|
4-Demethylcalycopterone
|
600.60
|
3.2
|
2
|
10
|
122.14
|
6
|
|
|
(4aR,8R,8aR)-4,4,8a-trimethyl-7-methylidene-8-(3-methylidenepent-4-enyl)-2,3,4a,5,6,8-hexahydro-1H-naphthalene
|
272.50
|
7.5
|
0
|
0
|
0
|
4
|
|
|
(2S,3S,4S,5R,6R)-6-[[(3S,4S,4aR,6aR,6bS,8aS,10S,12aR,14aR,14bR)-10-hydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-5-[(2R,3R,4S,5S,6S)-6-carboxy-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid
|
957.10
|
2.6
|
11
|
19
|
312.05
|
9
|
No matching records found on this page.