Mol:FL1CBFNP0001
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 |
| − | -3.2641 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2641 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2641 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2641 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5496 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5496 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8352 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8352 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8352 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8352 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5496 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5496 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9786 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9786 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.6931 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.6931 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5496 1.4437 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5496 1.4437 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2641 1.8562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2641 1.8562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1207 -1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1207 -1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4062 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4062 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3082 -1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3082 -1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3082 -1.8562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3082 -1.8562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0227 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0227 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7372 -1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7372 -1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4517 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4517 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4517 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4517 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7372 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7372 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0227 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0227 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3082 0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3082 0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4062 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4062 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7372 -1.8562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7372 -1.8562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1661 -1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1661 -1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8806 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8806 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8806 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8806 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1661 0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1661 0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.1628 0.9815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1628 0.9815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.6931 0.0630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.6931 0.0630 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 |
| − | 1 7 1 0 0 0 0 | + | 1 7 1 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 6 9 1 0 0 0 0 | + | 6 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 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 16 23 1 0 0 0 0 | + | 16 23 1 0 0 0 0 |
| − | 17 24 1 0 0 0 0 | + | 17 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 18 1 0 0 0 0 | + | 27 18 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 FL1CBFNP0001 | + | ID FL1CBFNP0001 |
| − | KNApSAcK_ID C00014490 | + | KNApSAcK_ID C00014490 |
| − | NAME Glychalcone B;6'',6''-Dimethylpyrano[2'',3'':4',3']-2'-hydroxy-3,4,6'-trimethoxychalcone | + | NAME Glychalcone B;6'',6''-Dimethylpyrano[2'',3'':4',3']-2'-hydroxy-3,4,6'-trimethoxychalcone |
| − | CAS_RN 143885-76-1 | + | CAS_RN 143885-76-1 |
| − | 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(c(OC)2)c(c(C=3)c(OC(C3)(C)C)c2)O)=O)OC | + | SMILES O(C)c(c1)c(ccc1C=CC(c(c(OC)2)c(c(C=3)c(OC(C3)(C)C)c2)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
-3.2641 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2641 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5496 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8352 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8352 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5496 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9786 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.6931 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5496 1.4437 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2641 1.8562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1207 -1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4062 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3082 -1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3082 -1.8562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0227 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7372 -1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4517 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4517 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7372 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0227 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3082 0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4062 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7372 -1.8562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1661 -1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8806 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8806 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1661 0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1628 0.9815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6931 0.0630 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
1 7 1 0 0 0 0
7 8 1 0 0 0 0
6 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
20 21 1 0 0 0 0
21 22 1 0 0 0 0
16 23 1 0 0 0 0
17 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 18 1 0 0 0 0
26 28 1 0 0 0 0
26 29 1 0 0 0 0
S SKP 8
ID FL1CBFNP0001
KNApSAcK_ID C00014490
NAME Glychalcone B;6'',6''-Dimethylpyrano[2'',3'':4',3']-2'-hydroxy-3,4,6'-trimethoxychalcone
CAS_RN 143885-76-1
FORMULA C23H24O6
EXACTMASS 396.1572885
AVERAGEMASS 396.43306
SMILES O(C)c(c1)c(ccc1C=CC(c(c(OC)2)c(c(C=3)c(OC(C3)(C)C)c2)O)=O)OC
M END
