| | COMPOUND: C13863 | |
Entry |
|
Name |
2,3-Di-O-phytanyl-sn-glycerol;
Archaeol
|
Formula |
C43H88O3
|
Exact mass |
652.6733
|
Mol weight |
653.157
|
Structure |
|
Brite |
Lipids [BR:br08002]
GL Glycerolipids
GL02 Diradylglycerols
GL0203 Dialkylglycerols
C13863 2,3-Di-O-phytanyl-sn-glycerol
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Other DBs |
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KCF data |
ATOM 46
1 O2a O 18.0159 -20.4451
2 C1c C 16.6548 -20.4451
3 C1b C 16.0948 -22.2793
4 O2a O 17.4559 -23.3293
5 C1b C 19.9900 -23.3293
6 C1c C 21.1632 -24.0332
7 C1b C 22.3365 -23.3293
8 C1b C 23.5566 -24.0332
9 C1b C 24.7299 -23.3293
10 C1c C 25.9032 -24.0332
11 C1b C 27.0763 -23.3293
12 C1b C 28.2966 -24.0332
13 C1b C 29.4697 -23.3293
14 C1c C 30.6430 -24.0332
15 C1b C 31.8632 -23.3293
16 C1b C 33.0364 -24.0332
17 C1b C 34.2097 -23.3293
18 C1c C 35.4298 -24.0332
19 C1a C 36.6031 -23.3293
20 C1b C 18.7698 -24.0332
21 C1b C 16.0248 -18.9609
22 O1a O 17.3159 -17.9109
23 C1a C 21.1632 -25.1595
24 C1a C 25.9032 -25.1595
25 C1a C 30.6430 -25.1595
26 C1a C 35.4298 -25.1595
27 C1b C 20.4561 -20.4451
28 C1c C 21.7232 -21.1490
29 C1b C 22.8965 -20.4451
30 C1b C 24.1636 -21.1490
31 C1b C 25.3837 -20.4451
32 C1c C 26.6040 -21.1490
33 C1b C 27.8241 -20.4451
34 C1b C 29.0442 -21.1490
35 C1b C 30.2645 -20.4451
36 C1c C 31.4846 -21.1490
37 C1b C 32.7517 -20.4451
38 C1b C 33.9718 -21.1490
39 C1b C 35.1451 -20.4451
40 C1c C 36.4592 -21.1490
41 C1a C 37.6323 -20.4451
42 C1b C 19.2360 -21.1490
43 C1a C 21.7232 -22.2753
44 C1a C 26.6040 -22.2753
45 C1a C 31.4846 -22.2753
46 C1a C 36.4592 -22.2753
BOND 45
1 2 1 1 #Up
2 2 3 1
3 3 4 1
4 5 6 1
5 6 7 1
6 7 8 1
7 8 9 1
8 9 10 1
9 10 11 1
10 11 12 1
11 12 13 1
12 13 14 1
13 14 15 1
14 15 16 1
15 16 17 1
16 17 18 1
17 18 19 1
18 5 20 1
19 20 4 1
20 2 21 1
21 21 22 1
22 6 23 1
23 10 24 1
24 14 25 1
25 18 26 1
26 27 28 1
27 28 29 1
28 29 30 1
29 30 31 1
30 31 32 1
31 32 33 1
32 33 34 1
33 34 35 1
34 35 36 1
35 36 37 1
36 37 38 1
37 38 39 1
38 39 40 1
39 40 41 1
40 27 42 1
41 28 43 1
42 32 44 1
43 36 45 1
44 40 46 1
45 42 1 1
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