Entry |
|
Name |
alpha,alpha'-Trehalose 6-palmitate
|
Formula |
C28H52O12
|
Exact mass |
580.3459
|
Mol weight |
580.7053
|
Structure |
|
Brite |
Lipids [BR:br08002]
SL Saccharolipids
SL03 Acyltrehaloses
C04265 alpha,alpha'-Trehalose 6-palmitate
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Other DBs |
|
LinkDB |
|
KCF data |
ATOM 40
1 C1y C 29.5755 -22.7412
2 O2a O 30.7830 -22.0348
3 O2x O 28.3489 -22.0411
4 C1y C 29.5755 -24.1541
5 C1y C 31.9968 -21.3412
6 C1y C 27.1414 -22.7412
7 C1y C 28.3489 -24.8671
8 O1a O 30.7830 -24.8477
9 O2x O 33.2042 -22.0605
10 C1y C 31.9968 -19.9281
11 C1y C 27.1414 -24.1541
12 C1b C 25.9276 -22.0411
13 O1a O 28.3424 -26.2606
14 C1y C 34.4309 -21.3412
15 C1y C 33.2042 -19.2345
16 O1a O 30.7893 -19.2345
17 O1a O 25.9276 -24.8477
18 O7a O 25.9339 -20.6539
19 C1y C 34.4309 -19.9281
20 C1b C 35.6447 -22.0411
21 O1a O 33.2042 -17.8344
22 C7a C 25.9339 -19.2539
23 O1a O 35.6384 -19.2282
24 O1a O 36.8522 -21.3412
25 C1b C 24.7265 -18.5601
26 O6a O 27.1414 -18.5537
27 C1b C 23.5192 -19.2539
28 C1b C 22.3052 -18.5601
29 C1b C 21.0979 -19.2539
30 C1b C 19.8905 -18.5601
31 C1b C 18.6767 -19.2539
32 C1b C 17.4692 -18.5601
33 C1b C 17.4692 -17.1600
34 C1b C 18.6767 -16.4601
35 C1b C 19.8905 -17.1600
36 C1b C 21.0979 -16.4601
37 C1b C 22.3052 -17.1600
38 C1b C 23.5192 -16.4601
39 C1b C 24.7265 -17.1600
40 C1a C 25.9339 -16.4601
BOND 41
1 1 2 1 #Down
2 1 3 1
3 1 4 1
4 5 2 1 #Down
5 3 6 1
6 4 7 1
7 4 8 1 #Down
8 5 9 1
9 5 10 1
10 6 11 1
11 6 12 1 #Up
12 7 13 1 #Up
13 9 14 1
14 10 15 1
15 10 16 1 #Down
16 11 17 1 #Down
17 12 18 1
18 14 19 1
19 14 20 1 #Up
20 15 21 1 #Up
21 18 22 1
22 19 23 1 #Down
23 20 24 1
24 22 25 1
25 22 26 2
26 25 27 1
27 27 28 1
28 28 29 1
29 29 30 1
30 30 31 1
31 31 32 1
32 32 33 1
33 33 34 1
34 34 35 1
35 35 36 1
36 36 37 1
37 37 38 1
38 38 39 1
39 39 40 1
40 7 11 1
41 15 19 1
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