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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
28-Galloylglucosylpomolate 3-arabinoside
|
919.10
|
3.2
|
10
|
17
|
282.59
|
9
|
|
|
Annuolide E
|
248.32
|
1.6
|
1
|
3
|
46.53
|
0
|
|
|
Dide-O-methyl-4-O-alpha-D-glucopyranosylsimmondsin
|
509.50
|
-5.9
|
10
|
15
|
263.01
|
6
|
|
|
Helianyl octanoate
|
554.90
|
13.3
|
0
|
2
|
26.3
|
15
|
|
|
Goyaglycoside-c
|
662.90
|
5.1
|
4
|
9
|
127.07
|
9
|
|
|
Epicatechin-(4beta-6)-epicatechin
|
578.50
|
2.4
|
10
|
12
|
220.76
|
3
|
|
|
(3R,4S)-3-(3,4-dihydroxyphenyl)-7-[(2R,3S,4S)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-1H-isochromene-4,6,8-triol
|
578.50
|
1.6
|
10
|
12
|
220.76
|
3
|
|
|
Epicatechin(4b->6)catechin
|
578.50
|
1.6
|
10
|
12
|
220.76
|
3
|
|
|
Catechin(4a->6) epicatechin
|
578.50
|
1.6
|
10
|
12
|
220.76
|
3
|
|
|
Gallocatechin-(4alpha->8)-catechin-(4alpha->8)-catechin
|
882.80
|
3
|
16
|
19
|
351.37
|
5
|
|
|
Catechin-(4alpha->8)-gallocatechin-(4alpha->8)-catechin
|
882.80
|
3
|
16
|
19
|
351.37
|
5
|
|
|
3b-Pregnadienolone 3-[rhamnosyl-(1->4)-rhamnosyl-(1->4)-rhamnosyl-(1->4)-glucoside]
|
915.00
|
-1.5
|
10
|
19
|
293.21
|
10
|
|
|
Diellagilactone
|
602.40
|
1.9
|
8
|
16
|
282.68
|
1
|
|
|
12-Methoxy-8,11,13-abietatrien-20,11-olide
|
328.40
|
5.3
|
0
|
3
|
35.53
|
2
|
|
|
2-(Methylthio)ethyl glucosinolate
|
393.50
|
-1.2
|
5
|
12
|
225.09
|
8
|
|
|
3-Methylbutyl glucosinolate
|
389.40
|
-0.2
|
5
|
11
|
199.79
|
8
|
|
|
2-Hydroxypentyl glucosinolate
|
405.40
|
-1.2
|
6
|
12
|
220.02
|
9
|
|
|
Pentyl glucosinolate
|
389.40
|
0.1
|
5
|
11
|
199.79
|
9
|
|
|
4-Phenylbutyl glucosinolate
|
451.50
|
1
|
5
|
11
|
199.79
|
10
|
|
|
5-Hexenyl glucosinolate
|
401.50
|
0.1
|
5
|
11
|
199.79
|
10
|
|
|
1-Thio-b-D-glucopyranose 1-[3-hydroxy-3-methyl-N-(sulfooxy)butanimidate]
|
391.40
|
-1.9
|
6
|
12
|
220.02
|
7
|
|
|
4-Methylpentyl glucosinolate
|
403.50
|
0.4
|
5
|
11
|
199.79
|
9
|
|
|
1-Thio-b-D-glucoside 1-[3-methyl-N-(sulfooxy)butanimidate], 9CI
|
375.40
|
-0.5
|
5
|
11
|
199.79
|
7
|
|
|
3-Phenylpropyl glucosinolate
|
437.50
|
0.4
|
5
|
11
|
199.79
|
9
|
|
|
Hexyl glucosinolate
|
403.50
|
0.6
|
5
|
11
|
199.79
|
10
|
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