| Entry |
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| Name |
Helenien;
Xantofyl palmitate
|
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| Formula |
C72H116O4
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| Exact mass |
1044.8874
|
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| Mol weight |
1045.689
|
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| Structure |
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| Remark |
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| Brite |
Therapeutic category of drugs in Japan [BR:br08301]
1 Agents affecting nervous system and sensory organs
13 Agents affecting sensory organs
131 Ophthalmic agents
1319 Others
D01031 Helenien (JAN); Xantofyl palmitate (INN)
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 76
1 C1y C 43.2288 -17.0994
2 C1z C 44.4414 -17.8067
3 C2y C 43.2288 -15.7030
4 C2b C 42.0072 -17.8251
5 C1x C 45.6447 -17.1085
6 C1a C 45.1303 -19.0193
7 C1a C 43.7248 -19.0193
8 C2x C 44.4414 -15.0051
9 C1a C 42.0072 -15.0051
10 C2b C 40.8039 -17.1085
11 C1y C 45.6540 -15.7030
12 C2c C 39.5913 -17.8067
13 O7a O 46.8573 -14.9958
14 C2b C 38.3790 -17.0994
15 C1a C 39.5913 -19.2028
16 C7a C 46.8389 -13.5996
17 C2b C 37.1664 -17.7973
18 C1b C 45.6356 -12.9014
19 O6a O 48.0515 -12.8921
20 C2b C 35.9631 -17.0994
21 C1b C 44.4140 -13.5996
22 C2c C 34.7412 -17.7973
23 C1b C 43.2104 -12.9014
24 C2b C 33.5379 -17.0994
25 C1a C 34.7322 -19.2028
26 C1b C 41.9981 -13.6180
27 C2b C 32.3254 -17.7790
28 C1b C 40.7855 -12.9198
29 C2b C 31.1037 -17.0810
30 C1b C 39.5729 -13.6180
31 C2b C 29.8911 -17.7790
32 C1b C 38.3606 -12.9198
33 C2c C 28.6878 -17.0810
34 C1b C 37.1571 -13.6180
35 C2b C 27.4753 -17.7790
36 C1a C 28.6878 -15.6756
37 C1b C 35.9354 -12.9382
38 C2b C 26.2629 -17.0717
39 C1b C 34.7228 -13.6364
40 C2b C 25.0503 -17.7699
41 C1b C 33.5196 -12.9382
42 C2c C 23.8377 -17.0627
43 C1b C 32.3070 -13.6364
44 C2b C 22.6254 -17.7606
45 C1a C 23.8894 -15.6572
46 C1b C 31.0946 -12.9382
47 C2b C 21.4219 -17.0533
48 C1b C 29.8821 -13.6454
49 C2y C 20.2096 -17.7515
50 C1a C 28.6695 -12.9472
51 C1z C 19.0060 -17.0533
52 C2y C 20.2096 -19.1570
53 C1x C 17.7844 -17.7515
54 C1a C 18.2897 -15.8226
55 C1a C 19.6858 -15.8226
56 C1x C 19.0060 -19.8549
57 C1a C 21.4219 -19.8549
58 C1y C 17.7844 -19.1570
59 O7a O 16.5718 -19.8459
60 C7a C 16.5627 -21.2513
61 C1b C 17.7753 -21.9492
62 O6a O 15.3501 -21.9402
63 C1b C 18.9876 -21.2604
64 C1b C 20.2002 -21.9492
65 C1b C 21.4128 -21.2513
66 C1b C 22.6254 -21.9402
67 C1b C 23.8377 -21.2420
68 C1b C 25.0503 -21.9402
69 C1b C 26.2536 -21.2236
70 C1b C 27.4662 -21.9311
71 C1b C 28.6878 -21.2236
72 C1b C 29.8911 -21.9218
73 C1b C 31.1037 -21.2236
74 C1b C 32.3254 -21.9128
75 C1b C 33.5379 -21.2146
76 C1a C 34.7412 -21.9128
BOND 77
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 2 5 1
5 2 6 1
6 2 7 1
7 3 8 2
8 3 9 1
9 4 10 2
10 5 11 1
11 10 12 1
12 11 13 1 #Down
13 12 14 2
14 12 15 1
15 13 16 1
16 14 17 1
17 16 18 1
18 16 19 2
19 17 20 2
20 18 21 1
21 20 22 1
22 21 23 1
23 22 24 2
24 22 25 1
25 23 26 1
26 24 27 1
27 26 28 1
28 27 29 2
29 28 30 1
30 29 31 1
31 30 32 1
32 31 33 2
33 32 34 1
34 33 35 1
35 33 36 1
36 34 37 1
37 35 38 2
38 37 39 1
39 38 40 1
40 39 41 1
41 40 42 2
42 41 43 1
43 42 44 1
44 42 45 1
45 43 46 1
46 44 47 2
47 46 48 1
48 47 49 1
49 48 50 1
50 49 51 1
51 49 52 2
52 51 53 1
53 51 54 1
54 51 55 1
55 52 56 1
56 52 57 1
57 53 58 1
58 58 59 1 #Up
59 59 60 1
60 60 61 1
61 60 62 2
62 61 63 1
63 63 64 1
64 64 65 1
65 65 66 1
66 66 67 1
67 67 68 1
68 68 69 1
69 69 70 1
70 70 71 1
71 71 72 1
72 72 73 1
73 73 74 1
74 74 75 1
75 75 76 1
76 8 11 1
77 56 58 1
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