COMPOUND: C15522
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Entry
C15522 Compound
Name
4a-Hydroxytetrahydrobiopterin;
4a-Hydroxy-5,6,4,8-tetrahydrobiopterin;
(6R)-6-(L-erythro-1,2-Dihydroxypropyl)-5,6,7,8-tetrahydro-4a-hydroxypterin;
6-[(1R,2S)-1,2-Dihydroxypropyl]-5,6,7,8-tetrahydro-4a-hydroxypterin
Formula
C9H15N5O4
Exact mass
257.1124
Mol weight
257.25
Structure
Mol file
KCF file
DB search
Reaction
R04734
R07211
R07212
R07213
R10729
Pathway
map00790
Folate biosynthesis
map01100
Metabolic pathways
Network
nt06016
Phenylalanine and tyrosine metabolism
Enzyme
1.14.16.1
1.14.16.2
1.14.16.4
1.14.16.7
4.2.1.96
Other DBs
PubChem:
17396514
ChEBI:
15642
NIKKAJI:
J2.794.818I
LinkDB
All DBs
KCF data
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ATOM 18
1 C2y C 17.4172 -17.6271
2 C1z C 17.4172 -16.1581
3 N1x N 18.6764 -18.3266
4 N2x N 16.2281 -18.3266
5 N1x N 18.6764 -15.4587
6 C5x C 16.2281 -15.4587
7 C1x C 19.8655 -17.6271
8 C2y C 15.0390 -17.6271
9 C1y C 19.8655 -16.1581
10 N2x N 15.0390 -16.1581
11 O5x O 16.2281 -14.0597
12 N1a N 13.7799 -18.3266
13 C1c C 21.1246 -15.5986
14 C1c C 22.3137 -16.2980
15 O1a O 21.1246 -14.1996
16 C1a C 23.5028 -15.5986
17 O1a O 22.3137 -17.5571
18 O1a O 17.4172 -14.7581
BOND 19
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 1
6 3 7 1
7 4 8 1
8 5 9 1
9 6 10 1
10 6 11 2
11 8 12 1
12 9 13 1
13 13 14 1
14 13 15 1 #Up
15 14 16 1
16 14 17 1 #Down
17 7 9 1
18 8 10 2
19 2 18 1 #Up
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