| Entry |
|
|---|
| Name |
Batatasin IV;
3-[2-(2-Hydroxyphenyl)ethyl]-5-methoxyphenol
|
|---|
| Formula |
C15H16O3
|
|---|
| Exact mass |
244.1099
|
|---|
| Mol weight |
244.2857
|
|---|
| Structure |
|
|---|
| Brite |
Lipids [BR:br08002]
PK Polyketides
PK13 Aromatic polyketides
PK1309 Diphenyl ethers, biphenyls, dibenzyls and stilbenes
C10247 Batatasin IV
Phytochemical compounds [BR:br08003]
Shikimate / acetate-malonate pathway derived compounds
Stilbenoids
Bibenzyls
C10247 Batatasin IV
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 18
1 C8x C 21.6853 -16.4314
2 C8y C 21.6853 -17.8321
3 C8x C 22.9022 -18.5289
4 C8y C 24.1118 -17.8321
5 C8x C 24.1118 -16.4314
6 C8y C 22.9022 -15.7275
7 C1b C 25.3264 -18.5279
8 C1b C 26.5398 -17.8302
9 C8y C 27.7543 -18.5262
10 C8x C 27.7533 -19.9220
11 C8x C 28.9677 -20.6249
12 C8x C 30.1741 -19.9201
13 C8x C 30.1731 -18.5196
14 C8y C 28.9656 -17.8165
15 O1a O 28.9619 -16.4160
16 O2a O 22.9039 -14.3269
17 O1a O 20.4787 -18.5294
18 C1a C 24.1188 -13.6246
BOND 19
1 8 9 1
2 3 4 1
3 4 5 2
4 5 6 1
5 6 1 2
6 9 10 1
7 10 11 2
8 11 12 1
9 12 13 2
10 13 14 1
11 14 9 2
12 4 7 1
13 14 15 1
14 1 2 1
15 6 16 1
16 7 8 1
17 2 17 1
18 2 3 2
19 16 18 1
|
|---|
