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Molfile:
Ideal
Representative
PDB:
Ideal
Representative
Other:
mmCif
CML
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H3T
(Stereoisomer)
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(Stereoisomer)
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PDB entries
PDBeChem : Chemical Bonds
Molecule :
DGG
Bonds between two atoms of the molecule
Total Number of Bonds: 125
50
10 per page
20 per page
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Record
First Atom
Second Atom
First Element
Second Element
Bond Order Type
Bond Length
Bond Stereochemistry
Is Aromatic
1
C16
C15
C
C
sing
1.52
N
N
2
C16
H161
C
H
sing
1.09
N
N
3
C16
H162
C
H
sing
1.1
N
N
4
C16
H163
C
H
sing
1.09
N
N
5
C15
C14
C
C
sing
1.53
N
N
6
C15
H151
C
H
sing
1.1
N
N
7
C15
H152
C
H
sing
1.1
N
N
8
C14
C13
C
C
sing
1.53
N
N
9
C14
H141
C
H
sing
1.1
N
N
10
C14
H142
C
H
sing
1.1
N
N
11
C13
C12
C
C
sing
1.53
N
N
12
C13
H131
C
H
sing
1.1
N
N
13
C13
H132
C
H
sing
1.1
N
N
14
C12
C11
C
C
sing
1.53
N
N
15
C12
H121
C
H
sing
1.1
N
N
16
C12
H122
C
H
sing
1.1
N
N
17
C11
C10
C
C
sing
1.53
N
N
18
C11
H111
C
H
sing
1.1
N
N
19
C11
H112
C
H
sing
1.1
N
N
20
C10
C9
C
C
sing
1.53
N
N
21
C10
H101
C
H
sing
1.1
N
N
22
C10
H102
C
H
sing
1.1
N
N
23
C9
C8
C
C
sing
1.53
N
N
24
C9
HC91
C
H
sing
1.1
N
N
25
C9
HC92
C
H
sing
1.1
N
N
26
C8
C7
C
C
sing
1.53
N
N
27
C8
HC81
C
H
sing
1.1
N
N
28
C8
HC82
C
H
sing
1.1
N
N
29
C7
C6
C
C
sing
1.53
N
N
30
C7
HC71
C
H
sing
1.1
N
N
31
C7
HC72
C
H
sing
1.1
N
N
32
C6
C5
C
C
sing
1.53
N
N
33
C6
HC61
C
H
sing
1.1
N
N
34
C6
HC62
C
H
sing
1.1
N
N
35
C5
C4
C
C
sing
1.53
N
N
36
C5
HC51
C
H
sing
1.09
N
N
37
C5
HC52
C
H
sing
1.1
N
N
38
C4
C3
C
C
sing
1.53
N
N
39
C4
HC41
C
H
sing
1.1
N
N
40
C4
HC42
C
H
sing
1.1
N
N
41
C3
C2
C
C
sing
1.53
N
N
42
C3
HC31
C
H
sing
1.1
N
N
43
C3
HC32
C
H
sing
1.1
N
N
44
C2
C1
C
C
sing
1.51
N
N
45
C2
HC21
C
H
sing
1.1
N
N
46
C2
HC22
C
H
sing
1.1
N
N
47
C1
O1
C
O
doub
1.22
N
N
48
C1
O17
C
O
sing
1.36
N
N
49
O17
C17
O
C
sing
1.43
N
N
50
C17
C19
C
C
sing
1.52
N
N
51
C17
H171
C
H
sing
1.09
N
N
52
C17
H172
C
H
sing
1.09
N
N
53
C19
O19
C
O
sing
1.43
N
N
54
C19
C18
C
C
sing
1.52
N
N
55
C19
H191
C
H
sing
1.1
N
N
56
O19
C21
O
C
sing
1.36
N
N
57
C21
O21
C
O
doub
1.22
N
N
58
C21
C22
C
C
sing
1.51
N
N
59
C22
C23
C
C
sing
1.53
N
N
60
C22
H221
C
H
sing
1.1
N
N
61
C22
H222
C
H
sing
1.1
N
N
62
C23
C24
C
C
sing
1.53
N
N
63
C23
H231
C
H
sing
1.1
N
N
64
C23
H232
C
H
sing
1.1
N
N
65
C24
C25
C
C
sing
1.53
N
N
66
C24
H241
C
H
sing
1.1
N
N
67
C24
H242
C
H
sing
1.09
N
N
68
C25
C26
C
C
sing
1.53
N
N
69
C25
H251
C
H
sing
1.1
N
N
70
C25
H252
C
H
sing
1.1
N
N
71
C26
C27
C
C
sing
1.53
N
N
72
C26
H261
C
H
sing
1.1
N
N
73
C26
H262
C
H
sing
1.1
N
N
74
C27
C28
C
C
sing
1.53
N
N
75
C27
H271
C
H
sing
1.1
N
N
76
C27
H272
C
H
sing
1.1
N
N
77
C28
C29
C
C
sing
1.52
N
N
78
C28
H281
C
H
sing
1.1
N
N
79
C28
H282
C
H
sing
1.1
N
N
80
C29
C30
C
C
sing
1.48
N
N
81
C29
C39
C
C
sing
1.48
N
N
82
C29
H291
C
H
sing
1.07
N
N
83
C30
C39
C
C
sing
1.5
N
N
84
C30
C31
C
C
sing
1.48
N
N
85
C30
H301
C
H
sing
1.08
N
N
86
C39
H391
C
H
sing
1.08
N
N
87
C39
H392
C
H
sing
1.08
N
N
88
C31
C32
C
C
sing
1.54
N
N
89
C31
H311
C
H
sing
1.11
N
N
90
C31
H312
C
H
sing
1.11
N
N
91
C32
C33
C
C
sing
1.53
N
N
92
C32
H321
C
H
sing
1.1
N
N
93
C32
H322
C
H
sing
1.1
N
N
94
C33
C34
C
C
sing
1.53
N
N
95
C33
H331
C
H
sing
1.1
N
N
96
C33
H332
C
H
sing
1.1
N
N
97
C34
C35
C
C
sing
1.53
N
N
98
C34
H341
C
H
sing
1.1
N
N
99
C34
H342
C
H
sing
1.1
N
N
100
C35
C36
C
C
sing
1.52
N
N
101
C35
H351
C
H
sing
1.1
N
N
102
C35
H352
C
H
sing
1.1
N
N
103
C36
H361
C
H
sing
1.09
N
N
104
C36
H362
C
H
sing
1.09
N
N
105
C36
H363
C
H
sing
1.09
N
N
106
C18
OP2
C
O
sing
1.42
N
N
107
C18
H181
C
H
sing
1.09
N
N
108
C18
H182
C
H
sing
1.09
N
N
109
P
OP1
P
O
sing
1.62
N
N
110
P
OP2
P
O
sing
1.62
N
N
111
P
OP3
P
O
doub
1.5
N
N
112
P
OP4
P
O
sing
1.62
N
N
113
OP1
HOP1
O
H
sing
0.98
N
N
114
OP4
C40
O
C
sing
1.42
N
N
115
C40
C41
C
C
sing
1.52
N
N
116
C40
H401
C
H
sing
1.1
N
N
117
C40
H402
C
H
sing
1.09
N
N
118
C41
O42
C
O
sing
1.43
N
N
119
C41
C43
C
C
sing
1.52
N
N
120
C41
H411
C
H
sing
1.1
N
N
121
O42
H421
O
H
sing
0.97
N
N
122
C43
O44
C
O
sing
1.42
N
N
123
C43
H431
C
H
sing
1.1
N
N
124
C43
H432
C
H
sing
1.09
N
N
125
O44
H441
O
H
sing
0.97
N
N