COMPOUND: C16070
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Entry
C16070 Compound
Name
6-(alpha-D-Glucosaminyl)-1D-myo-inositol 1,2-cyclic phosphate
Formula
C12H22NO12P
Exact mass
403.088
Mol weight
403.2763
Structure
Mol file
KCF file
DB search
Reaction
R07635
Enzyme
4.6.1.14
Other DBs
CAS:
140391-24-8
PubChem:
47205380
ChEBI:
52426
NIKKAJI:
J469.315I
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KCF data
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ATOM 26
1 O2x O 24.6156 -23.3839
2 C1y C 25.9350 -23.3929
3 C1y C 26.6114 -22.2308
4 C1y C 26.6075 -24.5596
5 C1y C 27.9569 -22.2274
6 O2a O 26.2070 -19.8841
7 C1y C 27.9437 -24.5751
8 O2x O 25.9282 -25.7097
9 C1y C 28.6224 -23.4083
10 O1a O 28.6213 -21.0822
11 O1a O 28.6032 -25.7386
12 O1a O 29.9621 -23.4056
13 C1y C 25.1267 -17.6519
14 C1y C 24.0325 -18.4307
15 O2x O 24.9953 -16.3164
16 C1y C 22.8162 -17.8747
17 N1a N 23.9576 -19.7616
18 C1y C 23.7720 -15.7601
19 C1y C 22.6777 -16.5390
20 O1a O 21.7384 -18.6467
21 C1b C 23.6541 -14.4506
22 O1a O 21.4819 -16.0018
23 O1a O 22.3529 -14.1127
24 P1b P 24.2656 -24.8764
25 O1c O 22.7731 -24.1064
26 O1c O 23.7756 -26.3688
BOND 28
1 5 9 1
2 5 10 1 #Up
3 7 11 1 #Up
4 9 12 1 #Down
5 7 9 1
6 2 1 1 #Up
7 2 3 1
8 2 4 1
9 3 5 1
10 3 6 1 #Down
11 4 7 1
12 4 8 1 #Up
13 13 14 1
14 13 6 1 #Down
15 13 15 1
16 14 16 1
17 14 17 1 #Down
18 15 18 1
19 16 19 1
20 16 20 1 #Up
21 18 21 1 #Up
22 19 22 1 #Down
23 21 23 1
24 18 19 1
25 1 24 1
26 8 24 1
27 24 25 2
28 24 26 1
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