COMPOUND: C22349
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Entry
C22349 Compound
Name
Bacterioruberin;
psi,psi-Carotene, 3,3',4,4'-tetradehydro-1,1',2,2'-tetrahydro-1,1'-dihydroxy-2,2'-bis(3-hydroxy-3-methylbutyl)-, (2S,2'S)-
Formula
C50H76O4
Exact mass
740.5744
Mol weight
741.136
Structure
Mol file
KCF file
DB search
Reaction
R12710
R12711
Pathway
map00906
Carotenoid biosynthesis
map01100
Metabolic pathways
map01110
Biosynthesis of secondary metabolites
Enzyme
4.2.1.161
Brite
Lipids [BR:
br08002
]
PR Prenol lipids
PR01 Isoprenoids
PR0108 Polyterpenes
C22349 Bacterioruberin
Secondary metabolites in pathway maps [
br08011.html
]
Biosynthetic pathways and modules of secondary metabolites
C22349
BRITE hierarchy
Other DBs
CAS:
32719-43-0
LIPIDMAPS:
LMPR01080032
LinkDB
All DBs
KCF data
Show
ATOM 54
1 C1a C 1.7509 -16.3832
2 C1d C 2.9412 -15.6830
3 C1c C 4.2014 -16.3832
4 C2b C 5.3916 -15.6830
5 C2b C 6.5819 -16.3832
6 C2c C 7.8421 -15.6830
7 C2b C 9.0323 -16.3832
8 C2b C 10.2226 -15.6830
9 C2b C 11.4828 -16.3832
10 C2c C 12.7431 -15.6830
11 C2b C 13.8633 -16.3832
12 C2b C 15.1235 -15.6830
13 C2b C 16.3138 -16.3832
14 C2c C 17.5040 -15.6830
15 C2b C 18.6942 -16.3832
16 C2b C 19.9545 -15.6830
17 C2b C 21.1447 -16.3832
18 C2b C 22.3349 -15.6830
19 C2c C 23.5952 -16.3832
20 C2b C 24.7854 -15.6830
21 C2b C 25.9756 -16.3832
22 C2b C 27.2359 -15.6830
23 C2c C 28.4261 -16.3832
24 C2b C 29.6163 -15.6830
25 C2b C 30.8766 -16.3832
26 C2b C 32.0668 -15.6830
27 C2c C 33.2570 -16.3832
28 C2b C 34.5173 -15.6830
29 C2b C 35.7075 -16.3832
30 C1c C 36.9678 -15.6830
31 C1d C 38.2280 -16.3832
32 C1a C 39.4182 -15.6830
33 O1a O 2.9412 -14.3528
34 C1a C 7.8421 -14.3528
35 C1a C 12.7431 -14.3528
36 C1a C 17.5040 -14.3528
37 C1a C 23.5952 -17.7834
38 C1a C 28.4261 -17.7834
39 C1a C 33.2570 -17.7834
40 C1b C 4.2014 -17.7834
41 C1b C 2.9412 -18.4836
42 C1d C 2.9412 -19.8839
43 C1a C 1.7509 -20.5840
44 C1a C 4.1314 -20.5840
45 O1a O 38.2280 -17.9935
46 C1a C 1.7509 -14.9829
47 C1b C 36.9678 -14.3528
48 C1b C 37.9479 -13.3026
49 C1d C 37.9479 -11.9023
50 C1a C 39.1382 -11.2022
51 C1a C 36.6877 -11.1322
52 C1a C 39.4182 -17.0833
53 O1a O 2.9412 -21.2841
54 O1a O 37.9479 -10.5023
BOND 53
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 2
5 5 6 1
6 6 7 2
7 7 8 1
8 8 9 2
9 9 10 1
10 10 11 2
11 11 12 1
12 12 13 2
13 13 14 1
14 14 15 2
15 15 16 1
16 16 17 2
17 17 18 1
18 18 19 2
19 19 20 1
20 20 21 2
21 21 22 1
22 22 23 2
23 23 24 1
24 24 25 2
25 25 26 1
26 26 27 2
27 27 28 1
28 28 29 2
29 29 30 1
30 30 31 1
31 31 32 1
32 2 33 1
33 6 34 1
34 10 35 1
35 14 36 1
36 19 37 1
37 23 38 1
38 27 39 1
39 3 40 1 #Down
40 40 41 1
41 41 42 1
42 42 43 1
43 42 44 1
44 31 45 1
45 2 46 1
46 30 47 1 #Down
47 47 48 1
48 48 49 1
49 49 50 1
50 49 51 1
51 31 52 1
52 42 53 1
53 49 54 1
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