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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
5,13,14-Trihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9-carboxylic acid
|
364.40
|
-0.7
|
4
|
7
|
124.29
|
1
|
|
|
Cryptocapsone
|
566.90
|
11.5
|
0
|
2
|
34.14
|
11
|
|
|
Hoduloside VII
|
931.10
|
0.6
|
11
|
18
|
294.98
|
12
|
|
|
Hoduloside VIII
|
917.10
|
-0.4
|
11
|
18
|
294.98
|
12
|
|
|
Hoduloside IX
|
1063.20
|
-1.5
|
13
|
22
|
353.9
|
14
|
|
|
Hoduloside X
|
1093.20
|
-1
|
14
|
23
|
374.13
|
15
|
|
|
Capsicoside B
|
1275.40
|
-3.5
|
18
|
30
|
474.9
|
20
|
|
|
3-trans-p-Coumaroylrotundic acid
|
634.80
|
7
|
4
|
7
|
124.29
|
6
|
|
|
Melitric acid B
|
520.40
|
4
|
5
|
11
|
180.05
|
8
|
|
|
23-trans-p-Coumaroyloxytormentic acid
|
650.80
|
6
|
5
|
8
|
144.52
|
6
|
|
|
Feruperine
|
287.35
|
2.9
|
1
|
3
|
49.77
|
4
|
|
|
Dihydroferuperine
|
289.40
|
1.7
|
1
|
3
|
49.77
|
4
|
|
|
Vitilagin
|
802.60
|
-1.5
|
12
|
23
|
383.49
|
6
|
|
|
4-[4,5-dihydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6-[[4-formyl-8,9-dihydroxy-4,6a,6b,11,11,14b-hexamethyl-8a-[[(E)-2-methylbut-2-enoyl]oxymethyl]-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3-hydroxy-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylic acid
|
1203.30
|
-0.4
|
14
|
26
|
417.5
|
16
|
|
|
Camelliasaponin B2
|
1203.30
|
0.1
|
14
|
26
|
417.5
|
16
|
|
|
Camelliasaponin C1
|
1205.30
|
0.3
|
15
|
26
|
420.66
|
16
|
|
|
3,9-Epoxy-1-p-menthene
|
152.23
|
1.8
|
0
|
1
|
9.23
|
0
|
|
|
3beta-12,21-Baccharadien-3-ol
|
426.70
|
9.3
|
1
|
1
|
20.23
|
3
|
|
|
Mukoenine B
|
347.40
|
6.8
|
2
|
2
|
53.09
|
6
|
|
|
Phytolaccoside I
|
943.10
|
0.4
|
11
|
19
|
312.05
|
10
|
|
|
Tryptophol [xylosyl-(1->6)-glucoside]
|
455.50
|
-2
|
7
|
10
|
174.09
|
7
|
|
|
(S)-Nerolidol 3-O-[a-L-rhamnopyranosyl-(1->4)-a-L-rhamnopyranosyl-(1->6)-b-D-glucopyranoside]
|
676.80
|
0.3
|
8
|
14
|
217.22
|
14
|
|
|
methyl (Z)-3-[3-methoxy-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoate
|
370.40
|
-0.2
|
4
|
9
|
134.91
|
7
|
|
|
1-O-2'-Hydroxy-4'-methoxycinnamoyl-b-D-glucose
|
356.32
|
-0.3
|
5
|
9
|
145.91
|
6
|
|
|
2-O-Caffeoyltartronic acid
|
282.20
|
0.9
|
4
|
8
|
141.36
|
6
|
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