COMPOUND: C14837
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Entry
C14837 Compound
Name
9,10-Dihydroxy-12,13-epoxyoctadecanoate;
9,10-Dihydroxy-12,13-epoxyoctadecanoic acid
Formula
C18H34O5
Exact mass
330.2406
Mol weight
330.46
Structure
Mol file
KCF file
DB search
Pathway
map00591
Linoleic acid metabolism
Brite
Lipids [BR:
br08002
]
FA Fatty acyls
FA02 Octadecanoids
FA0200 Other Octadecanoids
C14837 9,10-Dihydroxy-12,13-epoxyoctadecanoic acid
BRITE hierarchy
Other DBs
PubChem:
17395835
ChEBI:
34503
NIKKAJI:
J2.789.538G
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KCF data
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ATOM 23
1 C1b C 25.0685 -22.7339
2 C1b C 26.1963 -22.0705
3 C1b C 23.9408 -22.0705
4 C1c C 27.3904 -22.7339
5 C1b C 22.7466 -22.7339
6 C1c C 28.7171 -22.7339
7 C1b C 21.6189 -22.0705
8 C1b C 29.9113 -22.1369
9 C1b C 20.4911 -22.7339
10 C1y C 31.0390 -22.8002
11 C1b C 19.2970 -22.0705
12 C1y C 32.3659 -22.8002
13 C6a C 18.1692 -22.7339
14 C1b C 33.4936 -22.1369
15 O6a O 17.0414 -22.0705
16 O6a O 18.1692 -24.0607
17 C1b C 34.6213 -22.8002
18 C1b C 35.8155 -22.2032
19 C1b C 36.9432 -22.9330
20 C1a C 38.1374 -22.2695
21 O2x O 31.6316 -24.3596
22 O1a O 27.0343 -24.3891
23 O1a O 29.0416 -24.3877
BOND 23
1 1 2 1
2 1 3 1
3 2 4 1
4 3 5 1
5 4 6 1
6 5 7 1
7 6 8 1
8 7 9 1
9 8 10 1
10 9 11 1
11 10 12 1
12 11 13 1
13 12 14 1
14 13 15 1
15 13 16 2
16 14 17 1
17 17 18 1
18 18 19 1
19 19 20 1
20 10 21 1
21 12 21 1
22 4 22 1
23 6 23 1
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