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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
Lansiumamide C
|
265.30
|
3.8
|
0
|
1
|
20.31
|
5
|
|
|
Sambacin
|
540.60
|
-0.3
|
5
|
12
|
181.44
|
5
|
|
|
Trilobinone
|
316.40
|
4.8
|
2
|
3
|
57.53
|
1
|
|
|
8,11-dihydroxy-2-methyl-4-(2-methylprop-1-enyl)-2-[(E)-2-(1,4,5-trihydroxy-9-oxoxanthen-3-yl)ethenyl]-3,4-dihydropyrano[3,2-c]xanthen-7-one
|
620.60
|
7.5
|
5
|
10
|
170.8
|
3
|
|
|
Avenalumin II
|
279.29
|
3.3
|
0
|
4
|
52.33
|
3
|
|
|
1-Propenyl 1-(1-propenylthio)propyl disulfide
|
220.40
|
4.1
|
0
|
3
|
75.9
|
6
|
|
|
Fistuloside A
|
738.90
|
2
|
7
|
13
|
196.99
|
5
|
|
|
Fistuloside B
|
901.00
|
0.4
|
10
|
18
|
276.14
|
8
|
|
|
Fistuloside C
|
917.00
|
-0.6
|
11
|
19
|
296.37
|
9
|
|
|
Nepetariaside
|
348.39
|
0.2
|
5
|
8
|
136.68
|
6
|
|
|
Tangeraxanthin
|
484.70
|
9.4
|
1
|
2
|
37.3
|
10
|
|
|
Apo-3-lycopenal
|
416.60
|
10.4
|
0
|
1
|
17.07
|
12
|
|
|
Apo-10'-violaxanthal
|
408.60
|
6.5
|
1
|
3
|
49.83
|
8
|
|
|
5,6:5',6'-Diseco-b,b-carotene-5,5',6,6'-tetrone
|
600.90
|
10
|
0
|
4
|
68.28
|
20
|
|
|
Pyranomammea B
|
388.50
|
3.5
|
2
|
6
|
96.97
|
5
|
|
|
Apiumoside
|
570.50
|
1.7
|
5
|
12
|
185.35
|
8
|
|
|
(5a,6a,8a,11a)-8-Hydroxy-2-oxo-1(10),3-guaiadien-12,6-olide-15-al 8-(4-hydroxyphenylacetate)
|
410.40
|
1.7
|
1
|
7
|
106.97
|
5
|
|
|
Notoginsenoside T1
|
652.90
|
3.2
|
7
|
10
|
172.6
|
6
|
|
|
Notoginsenoside T2
|
666.90
|
3.7
|
6
|
10
|
161.6
|
7
|
|
|
Notoginsenoside R10
|
554.70
|
1.8
|
6
|
9
|
156.91
|
4
|
|
|
3-O-Methylniveusin A
|
408.40
|
0.4
|
2
|
8
|
111.52
|
5
|
|
|
Sudachiin B
|
666.60
|
0.2
|
6
|
17
|
250.34
|
14
|
|
|
Sudachiin C
|
666.60
|
0.2
|
6
|
17
|
250.34
|
14
|
|
|
Capsorubinidione
|
596.80
|
9.5
|
0
|
4
|
68.28
|
12
|
|
|
(6Z,10Z,14E,16E,18E,22E,26Z)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,10,14,16,18,22,26,30-nonaene
|
544.90
|
15.3
|
0
|
0
|
0
|
20
|
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