| | COMPOUND: C13740 | |
Entry |
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Name |
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Formula |
C11H18N5O12P3
|
Exact mass |
505.0165
|
Mol weight |
505.2082
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Structure |
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Other DBs |
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KCF data |
ATOM 31
1 P1b P 22.7241 -19.6888
2 O2c O 21.3280 -19.6888
3 O1c O 22.7183 -21.0850
4 O1c O 22.7183 -18.2869
5 P1b P 19.9263 -19.6830
6 O1c O 19.9205 -21.0791
7 O1c O 18.5304 -19.6715
8 O1c O 19.9205 -18.2812
9 N4y N 32.8214 -18.7902
10 C8y C 33.8787 -19.5262
11 C1y C 31.5365 -19.2051
12 C8x C 33.3005 -17.3942
13 C8y C 35.1111 -18.6207
14 N5x N 34.0188 -20.9457
15 O2x O 30.3976 -18.3523
16 C1y C 31.1044 -20.4551
17 N5x N 34.7492 -17.3299
18 C8y C 36.3672 -19.1699
19 C8x C 35.3391 -21.5356
20 C1y C 29.2875 -19.1465
21 C1y C 29.7200 -20.4551
22 O1a O 31.9103 -21.5941
23 N5x N 36.5308 -20.6536
24 N1a N 37.4770 -18.3463
25 C1b C 27.9675 -18.7203
26 O1a O 29.2757 -21.7751
27 O2b O 26.9337 -19.6548
28 P1b P 25.5318 -19.6548
29 O1c O 25.5261 -21.0508
30 O1c O 25.5261 -18.2585
31 C1b C 24.1298 -19.6553
BOND 33
1 5 8 2
2 1 2 1
3 1 3 1
4 1 4 2
5 2 5 1
6 5 6 1
7 9 10 1
8 11 9 1 #Up
9 9 12 1
10 10 13 2
11 10 14 1
12 11 15 1
13 11 16 1
14 12 17 2
15 13 18 1
16 14 19 2
17 15 20 1
18 16 21 1
19 16 22 1 #Down
20 18 23 2
21 18 24 1
22 20 25 1 #Up
23 21 26 1 #Down
24 25 27 1
25 27 28 1
26 28 29 1
27 28 30 2
28 13 17 1
29 19 23 1
30 20 21 1
31 5 7 1
32 28 31 1
33 31 1 1
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