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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
6-Hydroxy-3,3',4',5,7,8-hexamethoxyflavone
|
418.40
|
2.9
|
1
|
9
|
105.82
|
7
|
|
|
Prenyl arabinosyl-(1->6)-glucoside
|
380.39
|
-2.6
|
6
|
10
|
158.3
|
6
|
|
|
2-(hydroxymethyl)-6-[6-[[(E)-4-hydroxy-3-methylbut-2-enyl]amino]purin-9-yl]oxane-3,4,5-triol
|
381.38
|
-0.8
|
6
|
10
|
166.01
|
6
|
|
|
(3Z)-8a-hydroxy-8,8-dimethyl-3-[(4-methyl-5-oxo-2H-furan-2-yl)oxymethylidene]-5,6,7,8b-tetrahydro-3aH-indeno[1,2-b]furan-2-one
|
346.40
|
2
|
1
|
6
|
82.06
|
2
|
|
|
Notoginsenoside R9
|
654.90
|
2.6
|
8
|
10
|
180.3
|
7
|
|
|
Camelliatannin E
|
1074.80
|
2
|
19
|
28
|
498.8
|
4
|
|
|
Camelliatannin C
|
1074.80
|
2
|
19
|
28
|
498.8
|
4
|
|
|
Valeracetate
|
280.40
|
3.3
|
0
|
3
|
35.53
|
3
|
|
|
Aeglin
|
510.50
|
0.2
|
6
|
11
|
179.28
|
10
|
|
|
Taxifolin 3-arabinoside
|
436.40
|
0.5
|
7
|
11
|
186.37
|
4
|
|
|
[2-[3-[4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
|
902.80
|
0.1
|
12
|
22
|
354.65
|
13
|
|
|
[2-[3-[4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
|
932.80
|
0.1
|
12
|
23
|
363.88
|
14
|
|
|
[2-[3-[4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxy-5-hydroxy-6-(hydroxymethyl)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
|
1064.90
|
-1.5
|
15
|
27
|
433.8
|
16
|
|
|
5,16-Dihydroxy-11-methyl-6-methylidene-12-oxo-13-oxapentacyclo[9.3.3.15,8.01,10.02,8]octadecane-9-carboxylic acid
|
362.40
|
0.5
|
3
|
6
|
104.06
|
1
|
|
|
Isopentyl gentiobioside
|
412.40
|
-2.5
|
7
|
11
|
178.53
|
8
|
|
|
Isopropyl apiosylglucoside
|
354.35
|
-3
|
6
|
10
|
158.3
|
6
|
|
|
cis-Annonacin-10-one
|
594.90
|
7.4
|
3
|
7
|
113.29
|
26
|
|
|
(+)-Ginsenoside Rh4
|
620.90
|
5.6
|
6
|
8
|
139.84
|
6
|
|
|
Piperenol C
|
448.40
|
1.1
|
0
|
10
|
131.5
|
12
|
|
|
Elenolic acid 2-O-glucoside
|
404.40
|
-2
|
5
|
11
|
172.21
|
7
|
|
|
Cucurbitachrome 1
|
600.90
|
9.4
|
2
|
4
|
58.92
|
9
|
|
|
Setariol
|
414.60
|
4.9
|
3
|
3
|
60.69
|
6
|
|
|
3'-O-Methylequol
|
272.29
|
2.9
|
2
|
4
|
58.92
|
2
|
|
|
TG(14:0/20:2n6/20:4(5Z,8Z,11Z,14Z))
|
879.40
|
20.6
|
0
|
6
|
78.9
|
50
|
|
|
1-Palmitoyl-2-palmitoyl-3-behenoyl-glycerol
|
891.50
|
25.2
|
0
|
6
|
78.9
|
56
|
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