KSH2210-02044119
53 55 0 0 0 0 0 0 0 0999 V2000
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5.9614 -8.4236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6694 -10.6676 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.4458 -15.2994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9614 -9.9196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2611 -10.6676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7706 -12.9420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6544 -7.6755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2535 -7.6755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8738 -14.8007 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3623 -9.9272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6694 -12.1713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5531 -9.9196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6694 -6.1645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2611 -6.1645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9614 -5.4164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2611 -12.1713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0853 -12.1713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9796 -15.3674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0853 -10.6753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3774 -12.9193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0151 -16.7425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4809 -16.7501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3547 -5.4088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5531 -5.4088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4815 -9.6203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1822 -13.0591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5531 -12.3828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1347 -7.9755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7693 -7.9820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9674 -9.4755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7386 -9.4599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2609 -12.0704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8715 -12.7363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9584 -4.8164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5600 -11.8815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3243 -14.8763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5231 -15.6216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4938 -10.7757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8837 -10.1102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7630 -13.3790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9917 -13.3789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0207 -17.3414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5987 -16.8817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0622 -16.8988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4355 -17.3484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9699 -5.8692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8345 -5.1098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5588 -4.8446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3448 -4.8462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.0711 -5.1059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9414 -5.8663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1873 -10.9705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2 5 1 0 0 0 0
3 12 1 0 0 0 0
4 1 1 0 0 0 0
5 3 1 0 0 0 0
6 5 1 0 0 0 0
7 1 1 0 0 0 0
8 2 2 0 0 0 0
9 2 1 0 0 0 0
10 4 2 0 0 0 0
11 20 1 0 0 0 0
12 21 1 0 0 0 0
13 6 2 0 0 0 0
14 8 1 0 0 0 0
15 9 2 0 0 0 0
16 15 1 0 0 0 0
17 6 1 0 0 0 0
18 7 1 0 0 0 0
19 1 1 0 0 0 0
20 18 1 0 0 0 0
21 18 1 0 0 0 0
22 4 1 0 0 0 0
23 19 1 0 0 0 0
24 14 1 0 0 0 0
25 15 1 0 0 0 0
23 22 1 0 0 0 0
11 3 1 0 0 0 0
16 14 2 0 0 0 0
5 26 1 0 0 0 0
7 27 1 0 0 0 0
7 28 1 0 0 0 0
8 29 1 0 0 0 0
9 30 1 0 0 0 0
11 31 1 0 0 0 0
11 32 1 0 0 0 0
12 33 1 0 0 0 0
12 34 1 0 0 0 0
16 35 1 0 0 0 0
18 36 1 0 0 0 0
19 37 1 0 0 0 0
19 38 1 0 0 0 0
20 39 1 0 0 0 0
20 40 1 0 0 0 0
21 41 1 0 0 0 0
21 42 1 0 0 0 0
22 43 1 0 0 0 0
22 44 1 0 0 0 0
23 45 1 0 0 0 0
23 46 1 0 0 0 0
24 47 1 0 0 0 0
24 48 1 0 0 0 0
24 49 1 0 0 0 0
25 50 1 0 0 0 0
25 51 1 0 0 0 0
25 52 1 0 0 0 0
3 53 1 0 0 0 0
M END
>
KSH2210-02044119-01
>
Kishida2210
>
45897561
>
-
>
ChemBridge
>
KS131-3718563
>
C20H28N2O3
>
344.455
>
0
>
1
>
3
>
1
>
60.8500
>
-8.3717
>
-0.3489
>
-1.835
>
0.330
>
-4.100
>
OC(C(c2cc(cc(c2)C)C)N1CCC(CN3CCCC3=O)CC1)=O
>
97196012 97196011 72878487
$$$$