COMPOUND: C04299
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Entry
C04299 Compound
Name
D-myo-Inositol 1,2-cyclic phosphate;
1D-myo-Inositol 1,2-cyclic phosphate
Formula
C6H11O8P
Exact mass
242.0192
Mol weight
242.1205
Structure
Mol file
KCF file
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Reaction
R03333
R03364
Enzyme
3.1.4.43
4.6.1.13
Other DBs
CAS:
43119-57-9
PubChem:
6958
ChEBI:
18426
NIKKAJI:
J790.754K
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KCF data
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ATOM 15
1 P1b P 15.5950 -18.6524
2 O2x O 16.0804 -17.3788
3 O2x O 16.9316 -19.1568
4 O1c O 15.1160 -19.9383
5 O1c O 14.3153 -18.1732
6 C1y C 17.4863 -16.9313
7 C1y C 18.1735 -18.1353
8 C1y C 18.1924 -15.7398
9 C1y C 19.5414 -18.1480
10 C1y C 19.5856 -15.7461
11 O1a O 17.5178 -14.5484
12 C1y C 20.2476 -16.9565
13 O1a O 20.2160 -19.3458
14 O1a O 20.2853 -14.5672
15 O1a O 21.6219 -16.9755
BOND 16
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 2
5 6 2 1 #Up
6 7 3 1 #Up
7 6 8 1
8 7 9 1
9 8 10 1
10 8 11 1 #Down
11 9 12 1
12 9 13 1 #Up
13 10 14 1 #Up
14 12 15 1 #Down
15 6 7 1
16 10 12 1
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