Mol:FL2FCANM0003
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 22 24 0 0 0 0 0 0 0 0999 V2000 | + | 22 24 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.1458 0.2040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1458 0.2040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1446 -0.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1446 -0.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4279 -1.0315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4279 -1.0315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7157 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7157 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7158 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7158 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4303 0.6185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4303 0.6185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0011 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0011 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7133 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7133 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7121 0.2082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7121 0.2082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0014 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0014 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4287 0.6170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4287 0.6170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1421 0.2065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1421 0.2065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8565 0.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8565 0.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8564 1.4441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8564 1.4441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1419 1.8565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1419 1.8565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4275 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4275 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0032 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0032 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4321 -1.8565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4321 -1.8565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8581 0.6202 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8581 0.6202 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5247 1.8300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5247 1.8300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.5247 0.2353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5247 0.2353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4303 1.3263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4303 1.3263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 2 0 0 0 0 | + | 1 2 2 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
| − | 3 4 2 0 0 0 0 | + | 3 4 2 0 0 0 0 |
| − | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
| − | 5 6 2 0 0 0 0 | + | 5 6 2 0 0 0 0 |
| − | 6 1 1 0 0 0 0 | + | 6 1 1 0 0 0 0 |
| − | 4 7 1 0 0 0 0 | + | 4 7 1 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 8 9 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 10 5 1 0 0 0 0 | + | 10 5 1 0 0 0 0 |
| − | 9 11 1 0 0 0 0 | + | 9 11 1 0 0 0 0 |
| − | 11 12 2 0 0 0 0 | + | 11 12 2 0 0 0 0 |
| − | 12 13 1 0 0 0 0 | + | 12 13 1 0 0 0 0 |
| − | 13 14 2 0 0 0 0 | + | 13 14 2 0 0 0 0 |
| − | 14 15 1 0 0 0 0 | + | 14 15 1 0 0 0 0 |
| − | 15 16 2 0 0 0 0 | + | 15 16 2 0 0 0 0 |
| − | 16 11 1 0 0 0 0 | + | 16 11 1 0 0 0 0 |
| − | 7 17 2 0 0 0 0 | + | 7 17 2 0 0 0 0 |
| − | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
| − | 1 19 1 0 0 0 0 | + | 1 19 1 0 0 0 0 |
| − | 14 20 1 0 0 0 0 | + | 14 20 1 0 0 0 0 |
| − | 19 21 1 0 0 0 0 | + | 19 21 1 0 0 0 0 |
| − | 6 22 1 0 0 0 0 | + | 6 22 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FCANM0003 | + | ID FL2FCANM0003 |
| − | KNApSAcK_ID C00014148 | + | KNApSAcK_ID C00014148 |
| − | NAME 5,4'-Dihydroxy-7-methoxy-8-methylflavanone | + | NAME 5,4'-Dihydroxy-7-methoxy-8-methylflavanone |
| − | CAS_RN 329360-15-8 | + | CAS_RN 329360-15-8 |
| − | FORMULA C17H16O5 | + | FORMULA C17H16O5 |
| − | EXACTMASS 300.099773622 | + | EXACTMASS 300.099773622 |
| − | AVERAGEMASS 300.30593999999996 | + | AVERAGEMASS 300.30593999999996 |
| − | SMILES COc(c3)c(C)c(O1)c(c(O)3)C(=O)CC1c(c2)ccc(O)c2 | + | SMILES COc(c3)c(C)c(O1)c(c(O)3)C(=O)CC1c(c2)ccc(O)c2 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
22 24 0 0 0 0 0 0 0 0999 V2000
-2.1458 0.2040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1446 -0.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4279 -1.0315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7157 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7158 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4303 0.6185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0011 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7133 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7121 0.2082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0014 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4287 0.6170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1421 0.2065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8565 0.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8564 1.4441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1419 1.8565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4275 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0032 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4321 -1.8565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8581 0.6202 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5247 1.8300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5247 0.2353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4303 1.3263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
2 3 1 0 0 0 0
3 4 2 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
6 1 1 0 0 0 0
4 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
9 11 1 0 0 0 0
11 12 2 0 0 0 0
12 13 1 0 0 0 0
13 14 2 0 0 0 0
14 15 1 0 0 0 0
15 16 2 0 0 0 0
16 11 1 0 0 0 0
7 17 2 0 0 0 0
3 18 1 0 0 0 0
1 19 1 0 0 0 0
14 20 1 0 0 0 0
19 21 1 0 0 0 0
6 22 1 0 0 0 0
S SKP 8
ID FL2FCANM0003
KNApSAcK_ID C00014148
NAME 5,4'-Dihydroxy-7-methoxy-8-methylflavanone
CAS_RN 329360-15-8
FORMULA C17H16O5
EXACTMASS 300.099773622
AVERAGEMASS 300.30593999999996
SMILES COc(c3)c(C)c(O1)c(c(O)3)C(=O)CC1c(c2)ccc(O)c2
M END
