Mol:FL1CCFNP0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 29 31 0 0 0 0 0 0 0 0999 V2000 | + | 29 31 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.5006 -0.9347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5006 -0.9347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7862 -1.3472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7862 -1.3472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0717 -0.9347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0717 -0.9347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0717 -0.1097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0717 -0.1097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7862 0.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7862 0.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5006 -0.1097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5006 -0.1097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2151 0.3028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2151 0.3028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9296 -0.1097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9296 -0.1097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2151 -1.3472 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2151 -1.3472 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9296 -0.9347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9296 -0.9347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3572 0.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3572 0.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3572 -0.1097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3572 -0.1097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0717 0.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0717 0.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0717 1.1278 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0717 1.1278 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7862 -0.1097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7862 -0.1097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7862 -0.9347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7862 -0.9347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5006 -1.3472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5006 -1.3472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2151 -0.9347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2151 -0.9347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2151 -0.1097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2151 -0.1097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5006 0.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5006 0.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0717 -1.3472 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0717 -1.3472 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9296 -1.3472 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9296 -1.3472 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9296 -2.1722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9296 -2.1722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9296 0.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9296 0.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9296 1.1278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9296 1.1278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2151 1.5403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2151 1.5403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5006 1.1278 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5006 1.1278 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6848 2.1722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6848 2.1722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7454 2.1722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7454 2.1722 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 |
| − | 6 7 1 0 0 0 0 | + | 6 7 1 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 1 9 1 0 0 0 0 | + | 1 9 1 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 4 11 1 0 0 0 0 | + | 4 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 |
| − | 13 15 1 0 0 0 0 | + | 13 15 1 0 0 0 0 |
| − | 15 16 2 0 0 0 0 | + | 15 16 2 0 0 0 0 |
| − | 16 17 1 0 0 0 0 | + | 16 17 1 0 0 0 0 |
| − | 17 18 2 0 0 0 0 | + | 17 18 2 0 0 0 0 |
| − | 18 19 1 0 0 0 0 | + | 18 19 1 0 0 0 0 |
| − | 19 20 2 0 0 0 0 | + | 19 20 2 0 0 0 0 |
| − | 20 15 1 0 0 0 0 | + | 20 15 1 0 0 0 0 |
| − | 16 21 1 0 0 0 0 | + | 16 21 1 0 0 0 0 |
| − | 18 22 1 0 0 0 0 | + | 18 22 1 0 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | 19 24 1 0 0 0 0 | + | 19 24 1 0 0 0 0 |
| − | 24 25 2 0 0 0 0 | + | 24 25 2 0 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
| − | 27 20 1 0 0 0 0 | + | 27 20 1 0 0 0 0 |
| − | 26 28 1 0 0 0 0 | + | 26 28 1 0 0 0 0 |
| − | 26 29 1 0 0 0 0 | + | 26 29 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL1CCFNP0001 | + | ID FL1CCFNP0001 |
| − | KNApSAcK_ID C00014489 | + | KNApSAcK_ID C00014489 |
| − | NAME 6'',6''-Dimethylpyrano[2'',3'':6',5']-2'-hydroxy-3,4,4'-trimethoxychalcone | + | NAME 6'',6''-Dimethylpyrano[2'',3'':6',5']-2'-hydroxy-3,4,4'-trimethoxychalcone |
| − | CAS_RN 143885-79-4 | + | CAS_RN 143885-79-4 |
| − | FORMULA C23H24O6 | + | FORMULA C23H24O6 |
| − | EXACTMASS 396.1572885 | + | EXACTMASS 396.1572885 |
| − | AVERAGEMASS 396.43306 | + | AVERAGEMASS 396.43306 |
| − | SMILES O(C)c(c1)c(ccc1C=CC(c(c32)c(cc(OC)c2C=CC(O3)(C)C)O)=O)OC | + | SMILES O(C)c(c1)c(ccc1C=CC(c(c32)c(cc(OC)c2C=CC(O3)(C)C)O)=O)OC |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
29 31 0 0 0 0 0 0 0 0999 V2000
-2.5006 -0.9347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7862 -1.3472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0717 -0.9347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0717 -0.1097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7862 0.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5006 -0.1097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2151 0.3028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.9296 -0.1097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2151 -1.3472 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.9296 -0.9347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 0.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3572 -0.1097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 0.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 1.1278 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7862 -0.1097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7862 -0.9347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 -1.3472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2151 -0.9347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2151 -0.1097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 0.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 -1.3472 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9296 -1.3472 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9296 -2.1722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9296 0.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9296 1.1278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2151 1.5403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 1.1278 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6848 2.1722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7454 2.1722 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
6 7 1 0 0 0 0
7 8 1 0 0 0 0
1 9 1 0 0 0 0
9 10 1 0 0 0 0
4 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
13 15 1 0 0 0 0
15 16 2 0 0 0 0
16 17 1 0 0 0 0
17 18 2 0 0 0 0
18 19 1 0 0 0 0
19 20 2 0 0 0 0
20 15 1 0 0 0 0
16 21 1 0 0 0 0
18 22 1 0 0 0 0
22 23 1 0 0 0 0
19 24 1 0 0 0 0
24 25 2 0 0 0 0
25 26 1 0 0 0 0
26 27 1 0 0 0 0
27 20 1 0 0 0 0
26 28 1 0 0 0 0
26 29 1 0 0 0 0
S SKP 8
ID FL1CCFNP0001
KNApSAcK_ID C00014489
NAME 6'',6''-Dimethylpyrano[2'',3'':6',5']-2'-hydroxy-3,4,4'-trimethoxychalcone
CAS_RN 143885-79-4
FORMULA C23H24O6
EXACTMASS 396.1572885
AVERAGEMASS 396.43306
SMILES O(C)c(c1)c(ccc1C=CC(c(c32)c(cc(OC)c2C=CC(O3)(C)C)O)=O)OC
M END
