COMPOUND: C19799
Help
Entry
C19799 Compound
Name
Bis(1L-myo-inositol)-3,1'-phosphate 1-phosphate
Formula
C12H24O17P2
Exact mass
502.0489
Mol weight
502.2563
Structure
Mol file
KCF file
DB search
Reaction
R09670
Pathway
map00562
Inositol phosphate metabolism
map01100
Metabolic pathways
Enzyme
2.7.8.34
Other DBs
PubChem:
135626266
ChEBI:
62574
LinkDB
All DBs
KCF data
Show
ATOM 31
1 P1b P 7.6224 -20.0585
2 O2b O 7.6159 -18.6741
3 O1c O 6.2380 -20.1220
4 O1c O 7.6224 -21.4492
5 C1y C 7.6159 -17.2897
6 C1y C 6.4165 -16.5816
7 C1y C 8.8345 -16.5816
8 C1y C 6.4165 -15.1780
9 O1a O 5.2109 -17.2706
10 C1y C 8.8345 -15.1780
11 O1a O 10.0276 -17.2706
12 C1y C 7.6159 -14.4890
13 O1a O 5.2109 -14.4955
14 O1a O 10.1360 -14.4126
15 O1a O 7.6159 -13.0983
16 P1b P 11.4532 -25.6406
17 O2b O 11.4468 -24.2622
18 O1c O 12.8570 -25.6406
19 O1c O 10.0748 -25.7039
20 O1c O 11.4532 -27.0254
21 C1y C 11.4468 -22.8837
22 C1y C 10.2525 -22.1786
23 C1y C 12.6602 -22.1786
24 C1y C 10.2525 -20.7810
25 O1a O 9.0521 -22.8647
26 C1y C 12.6602 -20.7810
27 O1a O 13.8482 -22.8647
28 C1y C 11.4468 -20.0950
29 O2b O 9.0521 -20.1014
30 O1a O 13.9561 -20.0189
31 O1a O 11.4468 -18.7102
BOND 32
1 1 2 1
2 1 3 1
3 1 4 2
4 5 2 1 #Up
5 5 6 1
6 5 7 1
7 6 8 1
8 6 9 1 #Up
9 7 10 1
10 7 11 1 #Down
11 8 12 1
12 8 13 1 #Up
13 10 14 1 #Up
14 12 15 1 #Down
15 10 12 1
16 16 17 1
17 16 18 1
18 16 19 1
19 16 20 2
20 21 17 1 #Up
21 21 22 1
22 21 23 1
23 22 24 1
24 22 25 1 #Up
25 23 26 1
26 23 27 1 #Down
27 24 28 1
28 24 29 1 #Up
29 26 30 1 #Up
30 28 31 1 #Down
31 26 28 1
32 1 29 1
» Japanese version
DBGET
integrated database retrieval system