Mol:FL1C2CNF0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 25 28 0 0 0 0 0 0 0 0999 V2000 | + | 25 28 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.2339 0.2866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2339 0.2866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2339 -0.3557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2339 -0.3557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6776 -0.6769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6776 -0.6769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1213 -0.3557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1213 -0.3557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1213 0.2866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1213 0.2866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6776 0.6078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6776 0.6078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5650 -0.6769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5650 -0.6769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0087 -0.3557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0087 -0.3557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5474 -0.6768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5474 -0.6768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1035 -0.3557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1035 -0.3557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6645 -0.6796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6645 -0.6796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2255 -0.3557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2255 -0.3557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2255 0.2921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2255 0.2921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6645 0.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6645 0.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1035 0.2921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1035 0.2921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5650 -1.1782 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5650 -1.1782 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8448 0.4851 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8448 0.4851 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2224 -0.0345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2224 -0.0345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8448 -0.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8448 -0.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8416 -0.5559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8416 -0.5559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2224 -0.0318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2224 -0.0318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8416 0.4922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8416 0.4922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6776 1.2499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6776 1.2499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1140 -0.8374 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1140 -0.8374 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3995 -1.2499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3995 -1.2499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 2 3 2 0 0 0 0 | + | 2 3 2 0 0 0 0 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 4 5 2 0 0 0 0 | + | 4 5 2 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 6 1 2 0 0 0 0 | + | 6 1 2 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 2 0 0 0 0 | + | 8 9 2 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 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 10 1 0 0 0 0 | + | 15 10 1 0 0 0 0 |
| − | 7 16 2 0 0 0 0 | + | 7 16 2 0 0 0 0 |
| − | 1 17 1 0 0 0 0 | + | 1 17 1 0 0 0 0 |
| − | 17 18 1 0 0 0 0 | + | 17 18 1 0 0 0 0 |
| − | 18 19 2 0 0 0 0 | + | 18 19 2 0 0 0 0 |
| − | 19 2 1 0 0 0 0 | + | 19 2 1 0 0 0 0 |
| − | 12 20 1 0 0 0 0 | + | 12 20 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 |
| − | 22 13 1 0 0 0 0 | + | 22 13 1 0 0 0 0 |
| − | 6 23 1 0 0 0 0 | + | 6 23 1 0 0 0 0 |
| − | 3 24 1 0 0 0 0 | + | 3 24 1 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | M STY 1 1 SUP | + | M STY 1 1 SUP |
| − | M SLB 1 1 1 | + | M SLB 1 1 1 |
| − | M SAL 1 2 24 25 | + | M SAL 1 2 24 25 |
| − | M SBL 1 1 27 | + | M SBL 1 1 27 |
| − | M SMT 1 OCH3 | + | M SMT 1 OCH3 |
| − | M SBV 1 27 -6.2962 3.4055 | + | M SBV 1 27 -6.2962 3.4055 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL1C2CNF0001 | + | ID FL1C2CNF0001 |
| − | KNApSAcK_ID C00007025 | + | KNApSAcK_ID C00007025 |
| − | NAME 5'-Hydroxy-2'-methoxy-3,4-methylenedioxyfurano[2'',3'':4',3']chalcone | + | NAME 5'-Hydroxy-2'-methoxy-3,4-methylenedioxyfurano[2'',3'':4',3']chalcone |
| − | CAS_RN 61755-70-2 | + | CAS_RN 61755-70-2 |
| − | FORMULA C19H14O6 | + | FORMULA C19H14O6 |
| − | EXACTMASS 338.07903818 | + | EXACTMASS 338.07903818 |
| − | AVERAGEMASS 338.31086000000005 | + | AVERAGEMASS 338.31086000000005 |
| − | SMILES c(O4)(c1)c(OC4)ccc(C=CC(c(c3OC)cc(c(c32)occ2)O)=O)1 | + | SMILES c(O4)(c1)c(OC4)ccc(C=CC(c(c3OC)cc(c(c32)occ2)O)=O)1 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
25 28 0 0 0 0 0 0 0 0999 V2000
-2.2339 0.2866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2339 -0.3557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6776 -0.6769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1213 -0.3557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1213 0.2866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6776 0.6078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5650 -0.6769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0087 -0.3557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5474 -0.6768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1035 -0.3557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6645 -0.6796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2255 -0.3557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2255 0.2921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6645 0.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1035 0.2921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5650 -1.1782 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8448 0.4851 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2224 -0.0345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8448 -0.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8416 -0.5559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2224 -0.0318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8416 0.4922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6776 1.2499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1140 -0.8374 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3995 -1.2499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 2 0 0 0 0
3 4 1 0 0 0 0
4 5 2 0 0 0 0
5 6 1 0 0 0 0
6 1 2 0 0 0 0
4 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 2 0 0 0 0
9 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 10 1 0 0 0 0
7 16 2 0 0 0 0
1 17 1 0 0 0 0
17 18 1 0 0 0 0
18 19 2 0 0 0 0
19 2 1 0 0 0 0
12 20 1 0 0 0 0
20 21 1 0 0 0 0
21 22 1 0 0 0 0
22 13 1 0 0 0 0
6 23 1 0 0 0 0
3 24 1 0 0 0 0
24 25 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 24 25
M SBL 1 1 27
M SMT 1 OCH3
M SBV 1 27 -6.2962 3.4055
S SKP 8
ID FL1C2CNF0001
KNApSAcK_ID C00007025
NAME 5'-Hydroxy-2'-methoxy-3,4-methylenedioxyfurano[2'',3'':4',3']chalcone
CAS_RN 61755-70-2
FORMULA C19H14O6
EXACTMASS 338.07903818
AVERAGEMASS 338.31086000000005
SMILES c(O4)(c1)c(OC4)ccc(C=CC(c(c3OC)cc(c(c32)occ2)O)=O)1
M END
