| Entry |
|
|---|
| Name |
|
|---|
| Formula |
C14H14O3
|
|---|
| Exact mass |
230.0943
|
|---|
| Mol weight |
230.2592
|
|---|
| Structure |
|
|---|
| Brite |
Lipids [BR:br08002]
PK Polyketides
PK13 Aromatic polyketides
PK1309 Diphenyl ethers, biphenyls, dibenzyls and stilbenes
C10253 Demethylbatatasin IV
Phytochemical compounds [BR:br08003]
Shikimate / acetate-malonate pathway derived compounds
Stilbenoids
Bibenzyls
C10253 Demethylbatatasin IV
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 17
1 C8x C 21.7260 -16.0985
2 C8y C 21.7260 -17.4989
3 C8x C 22.9427 -18.2026
4 C8y C 24.1524 -17.4989
5 C8x C 24.1524 -16.0985
6 C8y C 22.9427 -15.4018
7 C1b C 25.3665 -18.2018
8 C1b C 26.5797 -17.4972
9 C8y C 27.7941 -18.1999
10 C8x C 27.7931 -19.5955
11 C8x C 29.0073 -20.2914
12 C8x C 30.2135 -19.5938
13 C8x C 30.2125 -18.1934
14 C8y C 29.0052 -17.4906
15 O1a O 22.9444 -14.0014
16 O1a O 20.5198 -18.2033
17 O1a O 29.0017 -16.0901
BOND 18
1 2 3 2
2 8 9 1
3 3 4 1
4 4 5 2
5 5 6 1
6 6 1 2
7 9 10 2
8 10 11 1
9 11 12 2
10 12 13 1
11 13 14 2
12 14 9 1
13 4 7 1
14 6 15 1
15 1 2 1
16 2 16 1
17 7 8 1
18 14 17 1
|
|---|
