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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
Aurochrome
|
568.90
|
11.3
|
0
|
2
|
18.46
|
8
|
|
|
Reticulataxanthin
|
472.70
|
9.2
|
1
|
2
|
37.3
|
10
|
|
|
[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl] 5,17-dihydroxy-11-methyl-6-methylidene-12-oxo-13-oxapentacyclo[9.3.3.15,8.01,10.02,8]octadecane-9-carboxylate
|
524.60
|
-1.3
|
6
|
11
|
183.21
|
4
|
|
|
Cymbopogonol
|
426.70
|
9.3
|
1
|
1
|
20.23
|
1
|
|
|
7',8'-Dihydro-e,y-carotene
|
538.90
|
14.6
|
0
|
0
|
0
|
14
|
|
|
Capsochrome
|
600.90
|
9.7
|
2
|
4
|
66.76
|
10
|
|
|
psi,psi-Carotene-16,16'-diol
|
568.90
|
13.1
|
2
|
2
|
40.46
|
18
|
|
|
Kryptocapsin
|
568.90
|
11.9
|
1
|
2
|
37.3
|
11
|
|
|
delta-Carotene-1,2-epoxide
|
552.90
|
13.3
|
0
|
1
|
12.53
|
13
|
|
|
(6Z,10Z,12E,14E,16E,18E,20Z,22E,26Z)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,10,12,14,16,18,20,22,26,30-undecaene
|
540.90
|
15.5
|
0
|
0
|
0
|
18
|
|
|
11,12-Dihydroxy-4,8-dimethyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadecane-2,4-dicarboxylic acid
|
364.40
|
1.3
|
4
|
6
|
115.06
|
2
|
|
|
8-Formyl-11,12-dihydroxy-4-methyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadecane-2,4-dicarboxylic acid
|
378.40
|
-0.3
|
4
|
7
|
132.13
|
3
|
|
|
Eleutheroside L
|
1205.40
|
-0.7
|
14
|
25
|
392.59
|
13
|
|
|
Sucrose 1',4'-(4,4'-dihydroxy-3,3'-dimethoxy-b-truxinate)
|
694.60
|
-1.6
|
8
|
17
|
260.59
|
8
|
|
|
Cafamarine
|
508.60
|
-0.1
|
6
|
10
|
170.05
|
5
|
|
|
4,5-Dihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9-carboxylic acid
|
348.40
|
0.2
|
3
|
6
|
104.06
|
1
|
|
|
Glycinoeclepin B
|
558.70
|
3.2
|
3
|
9
|
147.43
|
10
|
|
|
Glycinoeclepin C
|
514.60
|
2.5
|
3
|
8
|
130.36
|
5
|
|
|
Cymbopogone
|
426.70
|
9.7
|
0
|
1
|
17.07
|
1
|
|
|
(8S,8'S)-Secoisolariciresinol 9-xyloside
|
494.50
|
1
|
6
|
10
|
158.3
|
11
|
|
|
cis-p-Coumaric acid 4-[apiosyl-(1->2)-glucoside]
|
458.40
|
-1.5
|
7
|
12
|
195.6
|
8
|
|
|
Delphinidin 3-(6-p-coumaroylgalactoside)
|
611.50
|
|
9
|
13
|
238.13
|
8
|
|
|
Debenzoylzucchini factor B
|
559.80
|
8.5
|
2
|
4
|
72.55
|
4
|
|
|
5-[[6-[3-[[6-[[5-[[6-[2,3-Bis[(4-hydroxy-3-methoxyphenyl)methyl]-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-3-hydroxy-3-methyl-5-oxopentanoyl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxymethyl]-4-(4-hydroxy-3-methoxyphenyl)-2-[(4-hydroxy-3-methoxyphenyl)methyl]butoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-3-hydroxy-3-methyl-5-oxopentanoic acid
|
1643.60
|
-3.1
|
20
|
39
|
611.33
|
44
|
|
|
1-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-(4-hydroxy-2,6,6-trimethylcyclohexen-1-yl)-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-2,2-dimethyl-6-methylidenecyclohexane-1,4-diol
|
584.90
|
10.1
|
3
|
3
|
60.69
|
10
|
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