COMPOUND: C15604
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Entry
C15604 Compound
Name
Prenal
Formula
C5H8O(C5H8)n-1
Structure
Mol file
KCF file
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Comment
Generic compound in reaction hierarchy
Geranial (n=2) [CPD:
C01499
]
(2E,6E)-Farnesal (n=3) [CPD:
C03461
]
Reaction
R07360
Enzyme
1.8.3.5
Other DBs
PubChem:
17396596
ChEBI:
137934
NIKKAJI:
J9.338F
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KCF data
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ATOM 11
1 C2b C 18.6794 -17.2458
2 C2c C 17.4729 -16.5430
3 C4a C 19.8917 -16.5430
4 C1b C 16.2606 -17.2458
5 C1a C 17.4729 -15.1433
6 O4a O 21.1042 -17.2458
7 C1b C 15.0202 -16.5329
8 C2b C 13.8371 -17.2192
9 C2c C 12.6409 -16.5316
10 C1a C 11.4567 -17.2185
11 C1a C 12.6379 -15.1204
BOND 10
1 1 2 2
2 1 3 1
3 2 4 1
4 2 5 1
5 3 6 2
6 4 7 1
7 7 8 1
8 8 9 2
9 9 10 1
10 9 11 1
BRACKET 1 14.7700 -18.3400 14.7700 -15.6800
1 18.6900 -15.6800 18.6900 -18.3400
1 n-1
ORIGINAL 1 1 2 4 5 7
REPEAT 1
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