Entry |
|
Name |
Dihydrophaseic acid;
(-)-Dihydrophaseic acid
|
Formula |
C15H22O5
|
Exact mass |
282.1467
|
Mol weight |
282.3322
|
Structure |
|
Reaction |
|
Pathway |
|
Brite |
Lipids [BR:br08002]
PR Prenol lipids
PR01 Isoprenoids
PR0103 C15 isoprenoids (sesquiterpenes)
PR010305 Cyclofarnesane sesquiterpenoids
C15971 Dihydrophaseic acid
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Other DBs |
|
LinkDB |
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KCF data |
ATOM 20
1 C1z C 26.0014 -19.7382
2 C1z C 24.8406 -19.0650
3 C1z C 26.0014 -21.0846
4 C2b C 27.1620 -19.0650
5 C1x C 23.6684 -19.7382
6 C1x C 23.6625 -18.3919
7 C1a C 24.8291 -17.7186
8 O2x O 24.8291 -20.4114
9 C1x C 24.8406 -21.7578
10 C1a C 27.1736 -21.7578
11 C2b C 28.3286 -19.7382
12 C1y C 23.6684 -21.0846
13 C2c C 29.4892 -19.0650
14 C2b C 30.6557 -19.7382
15 C1a C 29.4892 -17.7186
16 C6a C 30.6561 -21.1267
17 O6a O 31.8585 -21.8207
18 O6a O 29.4537 -21.8212
19 O1a O 22.4713 -21.7782
20 O1a O 27.2138 -20.4382
BOND 21
1 1 4 1 #Up
2 2 5 1
3 2 6 1 #Down
4 2 7 1 #Up
5 3 8 1 #Down
6 3 9 1
7 3 10 1
8 4 11 2
9 5 12 1
10 11 13 1
11 13 14 2
12 13 15 1
13 6 8 1
14 9 12 1
15 14 16 1
16 1 2 1
17 16 17 1
18 1 3 1
19 16 18 2
20 12 19 1 #Up
21 1 20 1 #Down
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