COMPOUND: C01504
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Entry
C01504 Compound
Name
Indanone;
Hydrindone;
1-Indanone;
1H-Inden-1-one, 2,3-dihydro-
Formula
C9H8O
Exact mass
132.0575
Mol weight
132.1592
Structure
Mol file
KCF file
DB search
Reaction
R03582
R03583
R05430
R05431
R05432
R05433
R05540
Pathway
map00624
Polycyclic aromatic hydrocarbon degradation
map01120
Microbial metabolism in diverse environments
Enzyme
1.1.1.112
1.14.12.-
Other DBs
CAS:
83-33-0
PubChem:
4672
ChEBI:
17404
PDB-CCD:
1ON
[
PDBj
]
3DMET:
B00309
NIKKAJI:
J4.629I
LinkDB
All DBs
KCF data
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ATOM 10
1 C8y C 25.2702 -17.0398
2 C8y C 25.2702 -18.4457
3 C5x C 26.6059 -16.6117
4 C8x C 24.0497 -16.3434
5 C8x C 24.0497 -19.1551
6 C1x C 26.5996 -18.8740
7 C1x C 27.4239 -17.7493
8 O5x O 27.0405 -15.2889
9 C8x C 22.8482 -17.0398
10 C8x C 22.8482 -18.4457
BOND 11
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 2
8 4 9 2
9 5 10 2
10 6 7 1
11 9 10 1
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