Try searching for...
Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
(2R)-2-[(1S)-1-[(1S,2S,4S,5R,7S,9S,10S,11S,14R,15R,18S)-5,9-dihydroxy-10,14-dimethyl-7-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxy-3-oxapentacyclo[9.7.0.02,4.05,10.014,18]octadecan-15-yl]ethyl]-4,5-dimethyl-2,3-dihydropyran-6-one
|
798.90
|
0.1
|
9
|
16
|
257.82
|
8
|
|
|
(1S,2R,4R,5R,9S,10S,11S,12S,13R)-2,4,11,12-tetrahydroxy-2,11-dimethyl-6-methylidene-8,14-dioxatetracyclo[8.4.0.01,13.05,9]tetradecan-7-one
|
312.31
|
-1.8
|
4
|
7
|
119.75
|
0
|
|
|
(1S,2R,3R,5S,9S,10S,11S,12S,13R)-2,3,11,12-tetrahydroxy-2,11-dimethyl-6-methylidene-8,14-dioxatetracyclo[8.4.0.01,13.05,9]tetradecan-7-one
|
312.31
|
-1.8
|
4
|
7
|
119.75
|
0
|
|
|
(1S,2R,4R,5R,9S,10S,11S,12S,13R)-2-hydroperoxy-4,11,12-trihydroxy-2,11-dimethyl-6-methylidene-8,14-dioxatetracyclo[8.4.0.01,13.05,9]tetradecan-7-one
|
328.31
|
-1.7
|
4
|
8
|
128.98
|
1
|
|
|
Notoginsenoside R6
|
963.20
|
0.5
|
13
|
19
|
318.37
|
13
|
|
|
(1S,2R,5R,9R,12R,14S)-5,13,13-trimethyl-7,15-dioxahexacyclo[12.2.2.15,9.01,12.02,9.06,8]nonadecan-14-ol
|
318.40
|
3.5
|
1
|
3
|
41.99
|
0
|
|
|
(3S,5aR,5bR,7aS,11aS,11bR,13aR,13bR)-3-hydroxy-5a,5b,8,8,11a,13b-hexamethyl-3-propan-2-yl-1,2,6,7,7a,9,10,11,11b,12,13,13a-dodecahydrocyclopenta[a]chrysen-5-one
|
440.70
|
8
|
1
|
2
|
37.3
|
1
|
|
|
(2S,4aS,6aR,6aR,6bR,8aS,12aS,14aR,14bS)-2-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-4,5,6,6a,7,8,8a,10,11,12,13,14,14a,14b-tetradecahydro-3H-picen-1-one
|
428.70
|
8.6
|
1
|
2
|
37.3
|
0
|
|
|
[(3R,3aR,5aR,5bR,7aR,8R,11aS,13aS,13bR)-3a,5a,8,11a,13a-pentamethyl-3-propan-2-yl-1,2,3,4,5,5b,6,7,7a,9,10,11,13,13b-tetradecahydrocyclopenta[a]chrysen-8-yl]methanol
|
426.70
|
9.1
|
1
|
1
|
20.23
|
2
|
|
|
(2S)-2-(3,4-dihydroxyphenyl)-2,5,7-trihydroxychromene-3,4-dione
|
318.23
|
1.1
|
5
|
8
|
144.52
|
1
|
|
|
3-(4-Chlorophenoxy)-2-hydroxypropanoic acid
|
216.62
|
1.5
|
2
|
4
|
66.76
|
4
|
|
|
(1R,15S,16R,17S)-16-ethenyl-5-hydroxy-4,15-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]-14-oxa-10-azatetracyclo[8.8.0.02,7.012,17]octadeca-2,4,6,12-tetraen-11-one
|
653.60
|
-2.3
|
9
|
15
|
248.53
|
7
|
|
|
methyl (2S,3R,4S)-4-[[(1R)-2-acetyl-6,7-dihydroxy-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-3-ethenyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylate
|
727.70
|
-2.5
|
9
|
17
|
274.83
|
11
|
|
|
methyl (2S,3R,4S)-4-[[(1R)-2-acetyl-6,7-dihydroxy-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-3-ethenyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylate
|
727.70
|
-2.5
|
9
|
17
|
274.83
|
11
|
|
|
methyl (2S,3R,4S)-4-[[(1R,4R)-2-acetyl-4,6,7-trihydroxy-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-3-ethenyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylate
|
581.60
|
-1.5
|
7
|
13
|
215.91
|
8
|
|
|
3-[(7Z,10Z,13Z)-hexadeca-7,10,13-trienyl]-4-methoxy-5-methylidenefuran-2-one
|
344.50
|
6.6
|
0
|
3
|
35.53
|
13
|
|
|
3-[(7Z,10Z,13Z)-16-hydroxyhexadeca-7,10,13-trienyl]-4-methoxy-5-methylidenefuran-2-one
|
360.50
|
5.4
|
1
|
4
|
55.76
|
14
|
|
|
(3S,5R,8R,9R,10R,13R,14R,17S)-4,4,8,10,14-pentamethyl-17-[(2Z)-6-methylhepta-2,5-dien-2-yl]-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
|
426.70
|
9.9
|
1
|
1
|
20.23
|
3
|
|
|
(8S,9R,10R,13R,14S,16R,17R)-2-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-17-[(2R)-2,6-dihydroxy-6-methyl-3-oxoheptan-2-yl]-16-hydroxy-4,4,9,13,14-pentamethyl-8,10,12,15,16,17-hexahydro-7H-cyclopenta[a]phenanthrene-3,11-dione
|
824.90
|
-0.2
|
9
|
16
|
270.2
|
10
|
|
|
(8S,9R,10R,13R,14S,16R,17R)-2-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-17-[(2R)-2,6-dihydroxy-6-methyl-3-oxoheptan-2-yl]-16-hydroxy-4,4,9,13,14-pentamethyl-8,10,12,15,16,17-hexahydro-7H-cyclopenta[a]phenanthrene-3,11-dione
|
840.90
|
-0.7
|
10
|
17
|
290.43
|
11
|
|
|
(8S,9R,10R,13S,14S)-2-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-4,4,9,13,14-pentamethyl-7,8,10,12,15,17-hexahydrocyclopenta[a]phenanthrene-3,11,16-trione
|
664.70
|
-0.5
|
6
|
13
|
209.51
|
5
|
|
|
(2R,3R,4S,5S,6R)-2-[[(3S,8S,9R,10R,11R,13R,14S,17R)-17-[(2R,5R)-6-[(2R,3S,4S,5S,6R)-4,5-dihydroxy-6-methyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-methylheptan-2-yl]-11-hydroxy-4,4,9,13,14-pentamethyl-2,3,7,8,10,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
947.20
|
1.1
|
12
|
18
|
298.14
|
13
|
|
|
(1S,4aS,5aS,6S,10aR)-1-methyl-2'-oxospiro[1,4a,5,5a,7,8,10,10a-octahydropyrano[3,4-f]indolizine-6,3'-1H-indole]-4-carboxylic acid
|
354.40
|
-1
|
2
|
5
|
78.87
|
1
|
|
|
(3R)-6-hydroxy-4-methoxyspiro[1,2-dihydroindene-3,4'-cyclohex-2-ene]-1'-one
|
244.28
|
2.5
|
1
|
3
|
46.53
|
1
|
|
|
[(1R,2S,6S,7S,9S,10S,11S,12R,13S,14R)-2,6,9,11,13,14-hexahydroxy-7,10-dimethyl-3-methylidene-11-propan-2-yl-15-oxapentacyclo[7.5.1.01,6.07,13.010,14]pentadecan-12-yl] 1H-pyrrole-2-carboxylate
|
491.50
|
-1.1
|
7
|
9
|
172.7
|
4
|
No matching records found on this page.