COMPOUND: C04812
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Entry
C04812 Compound
Name
1D-1-Guanidino-3-amino-1,3-dideoxy-scyllo-inositol 4-phosphate
Formula
C7H17N4O7P
Exact mass
300.0835
Mol weight
300.2062
Structure
Mol file
KCF file
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Other DBs
PubChem:
7374
ChEBI:
27695
NIKKAJI:
J2.754.650A
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KCF data
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ATOM 19
1 C1y C 27.7843 -17.5586
2 C1y C 27.7843 -18.8766
3 C1y C 28.9098 -16.9055
4 N1b N 26.3556 -16.7305
5 C1y C 28.9098 -19.5414
6 O1a O 26.6529 -19.5238
7 C1y C 30.0530 -17.5586
8 O1a O 28.9041 -15.6107
9 C2c C 24.9209 -17.5527
10 C1y C 30.0530 -18.8766
11 N1a N 28.9041 -20.8477
12 O1a O 31.1785 -16.9055
13 N1a N 23.4922 -16.7247
14 N2a N 24.9152 -19.2089
15 O2b O 31.1785 -19.5238
16 P1b P 32.5785 -19.5238
17 O1c O 33.9785 -19.5238
18 O1c O 32.5785 -20.9238
19 O1c O 32.5785 -18.1238
BOND 19
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 2 5 1
5 2 6 1 #Down
6 3 7 1
7 3 8 1 #Down
8 4 9 1
9 5 10 1
10 5 11 1 #Up
11 7 12 1 #Up
12 9 13 1
13 9 14 2
14 10 15 1 #Down
15 7 10 1
16 15 16 1
17 16 17 1
18 16 18 2
19 16 19 1
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