COMPOUND: C06470
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Entry
C06470 Compound
Name
Muramic acid;
3-O-alpha-Carboxyethyl-D-glucosamine;
2-Amino-3-O-[(R)-1-carboxyethyl]-2-deoxy-D-glucopyranose
Formula
C9H17NO7
Exact mass
251.1005
Mol weight
251.23
Structure
Mol file
KCF file
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Brite
Compounds with biological roles [BR:
br08001
]
Carbohydrates
Monosaccharides
Amino sugars
C06470 Muramic acid
BRITE hierarchy
Other DBs
CAS:
1114-41-6
PubChem:
8702
ChEBI:
7027
PDB-CCD:
1S4
[
PDBj
]
MUR
[
PDBj
]
NIKKAJI:
J15.184J
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KCF data
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ATOM 17
1 C1y C 26.1302 -15.3300
2 C1y C 24.9398 -14.6336
3 C1y C 27.3328 -14.6336
4 O2a O 26.1363 -16.7052
5 C1y C 24.9398 -13.2526
6 O1a O 23.7552 -15.3300
7 C1y C 27.3328 -13.2526
8 N1a N 28.3863 -15.6753
9 C1c C 25.3862 -17.8495
10 O2x O 26.1302 -12.5560
11 C1b C 23.7552 -12.5560
12 O1a O 28.5293 -12.5560
13 C6a C 23.9635 -17.8718
14 C1a C 26.0589 -19.1695
15 O1a O 22.6956 -13.4608
16 O6a O 23.2908 -16.6218
17 O6a O 23.2135 -19.0863
BOND 17
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 #Either
12 9 13 1
13 9 14 1 #Down
14 11 15 1
15 13 16 1
16 13 17 2
17 7 10 1
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