COMPOUND: C05410
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Entry
C05410 Compound
Name
Gulono-1,4-lactone;
Gulonolactone
Formula
C6H10O6
Exact mass
178.0477
Mol weight
178.14
Structure
Mol file
KCF file
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CAS:
3327-64-8
PubChem:
7776
ChEBI:
177057
5571
NIKKAJI:
J206.919I
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KCF data
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ATOM 12
1 C7x C 21.6901 -17.7604
2 C1y C 22.1008 -19.0988
3 C1y C 23.5006 -19.1218
4 C1y C 23.9551 -17.7976
5 O7x O 22.8361 -16.9562
6 O6a O 20.3808 -17.3112
7 O1a O 21.2611 -20.2155
8 O1a O 24.3055 -20.2689
9 C1c C 25.1524 -17.0800
10 C1b C 26.3649 -17.7800
11 O1a O 27.5773 -17.0800
12 O1a O 25.1410 -15.6800
BOND 12
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 1 5 1
6 1 6 2
7 2 7 1 #Up
8 3 8 1 #Up
9 4 9 1
10 9 10 1
11 10 11 1
12 9 12 1 #Down
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