| Entry |
|
|---|
| Name |
Alizarin 2-methyl ether;
1-Hydroxy-2-methoxyanthraquinone
|
|---|
| Formula |
C15H10O4
|
|---|
| Exact mass |
254.0579
|
|---|
| Mol weight |
254.2375
|
|---|
| Structure |
|
|---|
| Brite |
Lipids [BR:br08002]
PK Polyketides
PK13 Aromatic polyketides
PK1304 Anthracenes and phenanthrenes
C10291 Alizarin 2-methyl ether
Phytochemical compounds [BR:br08003]
Polyketides
Anthraquinones
Anthraquinone type
C10291 Alizarin 2-methyl ether
|
|---|
| Other DBs |
|
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| LinkDB |
|
|---|
| KCF data |
ATOM 19
1 C8y C 26.5528 -17.1213
2 C8y C 26.5413 -18.5200
3 C5x C 25.3466 -16.4219
4 C8y C 27.7708 -16.4393
5 C5x C 25.3349 -19.2251
6 C8x C 27.7475 -19.2310
7 C8y C 24.1285 -17.1096
8 O5x O 25.3523 -15.0174
9 C8y C 28.9715 -17.1446
10 O1a O 27.7884 -15.0349
11 C8y C 24.1226 -18.5141
12 O5x O 25.3290 -20.6238
13 C8x C 28.9598 -18.5433
14 C8x C 22.9162 -16.4160
15 O2a O 30.1895 -16.4569
16 C8x C 22.9162 -19.2194
17 C8x C 21.6981 -17.1096
18 C1a C 31.4017 -17.1679
19 C8x C 21.6981 -18.5141
BOND 21
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 4 10 1
10 5 11 1
11 5 12 2
12 6 13 2
13 7 14 1
14 9 15 1
15 11 16 1
16 14 17 2
17 15 18 1
18 16 19 2
19 7 11 2
20 9 13 1
21 17 19 1
|
|---|
