Entry |
|
Name |
Bemotrizinol (USAN/INN); Tinosorb S (TN) |
Formula |
C38H49N3O5
|
Exact mass |
627.3672
|
Mol weight |
627.8128
|
Structure |
|
Efficacy |
Ultraviolet screen (UVA absorber) |
Comment |
intended for use as a topicl sunscreen
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 46
1 N5x N 15.8900 -20.3700
2 C8y C 15.8900 -21.7700
3 N5x N 17.1024 -22.4700
4 C8y C 18.3149 -21.7700
5 N5x N 18.3149 -20.3700
6 C8y C 17.1024 -19.6700
7 C8y C 17.1024 -18.2702
8 C8x C 18.2980 -17.5797
9 C8x C 18.2978 -16.1797
10 C8y C 17.0853 -15.4799
11 C8x C 15.8898 -16.1703
12 C8y C 15.8899 -17.5703
13 C8y C 19.5460 -22.4810
14 C8y C 19.5457 -23.8699
15 C8x C 20.7580 -24.5702
16 C8y C 21.9706 -23.8705
17 C8x C 21.9709 -22.4816
18 C8x C 20.7586 -21.7813
19 C8y C 14.6776 -22.4700
20 C8x C 13.4821 -21.7796
21 C8x C 12.2696 -22.4795
22 C8y C 12.2694 -23.8795
23 C8x C 13.4649 -24.5699
24 C8x C 14.6774 -23.8700
25 O2a O 17.0852 -14.0700
26 O1a O 14.6778 -18.2703
27 O2a O 11.0466 -24.5854
28 C1a C 9.8377 -23.8874
29 O1a O 18.3213 -24.5765
30 O2a O 23.1897 -24.5747
31 C1b C 24.3894 -23.8823
32 C1c C 25.5743 -24.5667
33 C1b C 26.7671 -23.8782
34 C1b C 27.9555 -24.5646
35 C1b C 29.1465 -23.8771
36 C1a C 30.3358 -24.5641
37 C1b C 25.5742 -25.9698
38 C1a C 26.7684 -26.6596
39 C1b C 15.8688 -13.3678
40 C1c C 14.6715 -14.0594
41 C1b C 13.4850 -13.3745
42 C1b C 12.2934 -14.0628
43 C1b C 11.1040 -13.3762
44 C1a C 9.9139 -14.0636
45 C1b C 14.6715 -15.4697
46 C1a C 13.4805 -16.1576
BOND 49
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 6 7 1
8 7 8 2
9 8 9 1
10 9 10 2
11 10 11 1
12 11 12 2
13 7 12 1
14 4 13 1
15 13 14 2
16 14 15 1
17 15 16 2
18 16 17 1
19 17 18 2
20 13 18 1
21 2 19 1
22 19 20 2
23 20 21 1
24 21 22 2
25 22 23 1
26 23 24 2
27 19 24 1
28 10 25 1
29 12 26 1
30 22 27 1
31 27 28 1
32 14 29 1
33 16 30 1
34 30 31 1
35 31 32 1
36 32 33 1
37 33 34 1
38 34 35 1
39 35 36 1
40 32 37 1
41 37 38 1
42 25 39 1
43 39 40 1
44 40 41 1
45 41 42 1
46 42 43 1
47 43 44 1
48 40 45 1
49 45 46 1
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