Mol:FL2FCBNS0001
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 |
| − | -2.4308 0.1449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4308 0.1449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4308 -0.4974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4308 -0.4974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8745 -0.8186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8745 -0.8186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3182 -0.4974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3182 -0.4974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3182 0.1449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3182 0.1449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8745 0.4661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8745 0.4661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7619 -0.8186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7619 -0.8186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2056 -0.4974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2056 -0.4974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2056 0.1449 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | -0.2056 0.1449 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | -0.7619 0.4661 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7619 0.4661 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3505 0.4660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3505 0.4660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9175 0.1386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9175 0.1386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4845 0.4660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4845 0.4660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4845 1.1207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4845 1.1207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9175 1.4480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9175 1.4480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3505 1.1207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3505 1.1207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7619 -1.3624 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7619 -1.3624 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8745 -1.4608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8745 -1.4608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7880 0.7637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7880 0.7637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2879 1.6298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2879 1.6298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0735 1.4608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0735 1.4608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7880 1.0483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7880 1.0483 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 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 |
| − | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
| − | 14 21 1 0 0 0 0 | + | 14 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | M STY 1 2 SUP | + | M STY 1 2 SUP |
| − | M SLB 1 2 2 | + | M SLB 1 2 2 |
| − | M SAL 2 2 21 22 | + | M SAL 2 2 21 22 |
| − | M SBL 2 1 23 | + | M SBL 2 1 23 |
| − | M SMT 2 OCH3 | + | M SMT 2 OCH3 |
| − | M SVB 2 23 2.0735 1.4608 | + | M SVB 2 23 2.0735 1.4608 |
| − | M STY 1 1 SUP | + | M STY 1 1 SUP |
| − | M SLB 1 1 1 | + | M SLB 1 1 1 |
| − | M SAL 1 2 19 20 | + | M SAL 1 2 19 20 |
| − | M SBL 1 1 21 | + | M SBL 1 1 21 |
| − | M SMT 1 OCH3 | + | M SMT 1 OCH3 |
| − | M SVB 1 21 -2.788 0.7637 | + | M SVB 1 21 -2.788 0.7637 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FCBNS0001 | + | ID FL2FCBNS0001 |
| − | KNApSAcK_ID C00008226 | + | KNApSAcK_ID C00008226 |
| − | NAME Naringenin 7,4'-dimethyl ether | + | NAME Naringenin 7,4'-dimethyl ether |
| − | CAS_RN 29424-96-2 | + | CAS_RN 29424-96-2 |
| − | FORMULA C17H16O5 | + | FORMULA C17H16O5 |
| − | EXACTMASS 300.099773622 | + | EXACTMASS 300.099773622 |
| − | AVERAGEMASS 300.30593999999996 | + | AVERAGEMASS 300.30593999999996 |
| − | SMILES COc(c3)ccc(c3)C(C1)Oc(c2)c(c(O)cc(OC)2)C(=O)1 | + | SMILES COc(c3)ccc(c3)C(C1)Oc(c2)c(c(O)cc(OC)2)C(=O)1 |
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
-2.4308 0.1449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4308 -0.4974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8745 -0.8186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3182 -0.4974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3182 0.1449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8745 0.4661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7619 -0.8186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2056 -0.4974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2056 0.1449 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
-0.7619 0.4661 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3505 0.4660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9175 0.1386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4845 0.4660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4845 1.1207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9175 1.4480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3505 1.1207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7619 -1.3624 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8745 -1.4608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7880 0.7637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2879 1.6298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0735 1.4608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7880 1.0483 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 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
19 20 1 0 0 0 0
14 21 1 0 0 0 0
21 22 1 0 0 0 0
M STY 1 2 SUP
M SLB 1 2 2
M SAL 2 2 21 22
M SBL 2 1 23
M SMT 2 OCH3
M SVB 2 23 2.0735 1.4608
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 19 20
M SBL 1 1 21
M SMT 1 OCH3
M SVB 1 21 -2.788 0.7637
S SKP 8
ID FL2FCBNS0001
KNApSAcK_ID C00008226
NAME Naringenin 7,4'-dimethyl ether
CAS_RN 29424-96-2
FORMULA C17H16O5
EXACTMASS 300.099773622
AVERAGEMASS 300.30593999999996
SMILES COc(c3)ccc(c3)C(C1)Oc(c2)c(c(O)cc(OC)2)C(=O)1
M END
