Mol:FL1CRTNF0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 26 28 0 0 0 0 0 0 0 0999 V2000 | + | 26 28 0 0 0 0 0 0 0 0999 V2000 |
| − | -3.7789 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.7789 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.7789 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.7789 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0644 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0644 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3500 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3500 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3500 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3500 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0644 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0644 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.4934 -1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.4934 -1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6355 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6355 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6355 1.0313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6355 1.0313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9210 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9210 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2066 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2066 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5079 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5079 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5079 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5079 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2224 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2224 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9368 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9368 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9368 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9368 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2224 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2224 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7215 -1.2862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7215 -1.2862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2064 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2064 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7215 0.0487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7215 0.0487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2224 1.0313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2224 1.0313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5079 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5079 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6684 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6684 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9909 -0.0602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9909 -0.0602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9456 -1.0988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9456 -1.0988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.4934 -0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.4934 -0.6188 0.0000 O 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 |
| − | 2 7 1 0 0 0 0 | + | 2 7 1 0 0 0 0 |
| − | 5 8 1 0 0 0 0 | + | 5 8 1 0 0 0 0 |
| − | 8 9 2 0 0 0 0 | + | 8 9 2 0 0 0 0 |
| − | 8 10 1 0 0 0 0 | + | 8 10 1 0 0 0 0 |
| − | 10 11 2 0 0 0 0 | + | 10 11 2 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 12 13 2 0 0 0 0 | + | 12 13 2 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | 14 15 2 0 0 0 0 | + | 14 15 2 0 0 0 0 |
| − | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
| − | 16 17 2 0 0 0 0 | + | 16 17 2 0 0 0 0 |
| − | 17 12 1 0 0 0 0 | + | 17 12 1 0 0 0 0 |
| − | 15 18 1 0 0 0 0 | + | 15 18 1 0 0 0 0 |
| − | 18 19 1 0 0 0 0 | + | 18 19 1 0 0 0 0 |
| − | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
| − | 20 16 1 0 0 0 0 | + | 20 16 1 0 0 0 0 |
| − | 17 21 1 0 0 0 0 | + | 17 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 19 23 1 0 0 0 0 | + | 19 23 1 0 0 0 0 |
| − | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
| − | 23 25 1 0 0 0 0 | + | 23 25 1 0 0 0 0 |
| − | 23 26 1 0 0 0 0 | + | 23 26 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL1CRTNF0001 | + | ID FL1CRTNF0001 |
| − | KNApSAcK_ID C00014470 | + | KNApSAcK_ID C00014470 |
| − | NAME Licoagrochalcone D;5''-(2-Hydroxyisopropyl)-4'',5''-dihydrofurano[2'',3'':4,3]-4'-hydroxy-2-methoxychalcone | + | NAME Licoagrochalcone D;5''-(2-Hydroxyisopropyl)-4'',5''-dihydrofurano[2'',3'':4,3]-4'-hydroxy-2-methoxychalcone |
| − | CAS_RN 325144-69-2 | + | CAS_RN 325144-69-2 |
| − | FORMULA C21H22O5 | + | FORMULA C21H22O5 |
| − | EXACTMASS 354.146723814 | + | EXACTMASS 354.146723814 |
| − | AVERAGEMASS 354.39638 | + | AVERAGEMASS 354.39638 |
| − | SMILES COc(c12)c(C=CC(=O)c(c3)ccc(O)c3)ccc1OC(C(C)(C)O)C2 | + | SMILES COc(c12)c(C=CC(=O)c(c3)ccc(O)c3)ccc1OC(C(C)(C)O)C2 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
26 28 0 0 0 0 0 0 0 0999 V2000
-3.7789 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7789 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0644 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3500 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3500 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0644 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4934 -1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6355 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6355 1.0313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9210 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2066 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5079 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5079 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2224 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9368 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9368 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2224 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7215 -1.2862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2064 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7215 0.0487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2224 1.0313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5079 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6684 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9909 -0.0602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9456 -1.0988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4934 -0.6188 0.0000 O 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
2 7 1 0 0 0 0
5 8 1 0 0 0 0
8 9 2 0 0 0 0
8 10 1 0 0 0 0
10 11 2 0 0 0 0
11 12 1 0 0 0 0
12 13 2 0 0 0 0
13 14 1 0 0 0 0
14 15 2 0 0 0 0
15 16 1 0 0 0 0
16 17 2 0 0 0 0
17 12 1 0 0 0 0
15 18 1 0 0 0 0
18 19 1 0 0 0 0
19 20 1 0 0 0 0
20 16 1 0 0 0 0
17 21 1 0 0 0 0
21 22 1 0 0 0 0
19 23 1 0 0 0 0
23 24 1 0 0 0 0
23 25 1 0 0 0 0
23 26 1 0 0 0 0
S SKP 8
ID FL1CRTNF0001
KNApSAcK_ID C00014470
NAME Licoagrochalcone D;5''-(2-Hydroxyisopropyl)-4'',5''-dihydrofurano[2'',3'':4,3]-4'-hydroxy-2-methoxychalcone
CAS_RN 325144-69-2
FORMULA C21H22O5
EXACTMASS 354.146723814
AVERAGEMASS 354.39638
SMILES COc(c12)c(C=CC(=O)c(c3)ccc(O)c3)ccc1OC(C(C)(C)O)C2
M END
