COMPOUND: C22291
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Entry
C22291 Compound
Name
3,3'-Di-O-methyl-4alpha-mannobiose;
3-O-Methyl-alpha-D-mannopyranosyl-(1->4)-3-O-methyl-alpha-D-mannopyranose
Formula
C14H26O11
Exact mass
370.1475
Mol weight
370.3496
Structure
Mol file
KCF file
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Reaction
R12632
Enzyme
2.1.1.365
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KCF data
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ATOM 25
1 C1y C 20.3417 -13.0422
2 C1y C 20.3417 -14.4604
3 O2x O 21.5473 -12.3331
4 C1b C 19.1362 -12.3331
5 C1y C 21.5473 -15.1695
6 C1y C 22.8236 -13.0422
7 O1a O 18.0016 -13.2549
8 C1y C 22.8236 -14.4604
9 O1a O 24.0291 -12.3331
10 O1a O 24.0291 -15.1695
11 O2a O 21.5473 -16.5877
12 C1y C 17.9307 -17.2259
13 C1y C 16.7253 -17.9351
14 C1y C 17.9307 -15.8786
15 C1y C 15.5197 -17.2259
16 O2a O 16.7253 -19.2824
17 O2x O 16.7253 -15.1695
18 C1y C 15.5197 -15.8786
19 O1a O 14.3852 -17.9351
20 C1b C 14.3852 -15.1695
21 O1a O 13.3216 -16.0913
22 O2a O 19.1619 -15.1745
23 O1a O 19.1789 -17.9397
24 C1a C 22.7591 -17.2874
25 C1a C 15.4989 -19.9901
BOND 26
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 2 5 1
5 3 6 1
6 4 7 1
7 5 8 1
8 6 9 1 #Down
9 8 10 1 #Up
10 6 8 1
11 5 11 1 #Up
12 12 13 1
13 12 14 1
14 13 15 1
15 13 16 1 #Up
16 14 17 1
17 15 18 1
18 15 19 1 #Down
19 18 20 1 #Up
20 20 21 1
21 17 18 1
22 14 22 1 #Down
23 2 22 1 #Down
24 12 23 1 #Up
25 11 24 1
26 16 25 1
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