Mol:FLIA19NM0002
From Metabolomics.JP
(Difference between revisions)
| Line 1: | Line 1: | ||
| − | + | ||
| − | + | ||
| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 20 22 0 0 0 0 0 0 0 0999 V2000 | + | 20 22 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.8068 0.6874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8068 0.6874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8068 0.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8068 0.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2505 -0.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2505 -0.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6942 0.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6942 0.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6942 0.6874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6942 0.6874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2505 1.0086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2505 1.0086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1379 -0.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1379 -0.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4184 0.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4184 0.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4184 0.6874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4184 0.6874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1379 1.0086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1379 1.0086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9745 -0.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9745 -0.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9745 -0.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9745 -0.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5693 -1.3062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5693 -1.3062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1641 -0.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1641 -0.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1641 -0.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1641 -0.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5693 0.0674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5693 0.0674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1379 -0.9182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1379 -0.9182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9745 1.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9745 1.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1641 1.3062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1641 1.3062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6641 2.1722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6641 2.1722 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 5 1 0 0 0 0 | + | 10 5 1 0 0 0 0 |
| − | 8 11 1 0 0 0 0 | + | 8 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 |
| − | 9 18 1 0 0 0 0 | + | 9 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 |
| − | 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 -2.1641 1.3062 | + | M SVB 1 21 -2.1641 1.3062 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FLIA19NM0002 | + | ID FLIA19NM0002 |
| − | KNApSAcK_ID C00009381 | + | KNApSAcK_ID C00009381 |
| − | NAME 7-Methoxy-2-methylisoflavone | + | NAME 7-Methoxy-2-methylisoflavone |
| − | CAS_RN 19725-44-1 | + | CAS_RN 19725-44-1 |
| − | FORMULA C17H14O3 | + | FORMULA C17H14O3 |
| − | EXACTMASS 266.09429431399997 | + | EXACTMASS 266.09429431399997 |
| − | AVERAGEMASS 266.29125999999997 | + | AVERAGEMASS 266.29125999999997 |
| − | SMILES COc(c3)cc(O1)c(c3)C(=O)C(c(c2)cccc2)=C(C)1 | + | SMILES COc(c3)cc(O1)c(c3)C(=O)C(c(c2)cccc2)=C(C)1 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
20 22 0 0 0 0 0 0 0 0999 V2000
-1.8068 0.6874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8068 0.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2505 -0.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6942 0.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6942 0.6874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2505 1.0086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1379 -0.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4184 0.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4184 0.6874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1379 1.0086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9745 -0.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9745 -0.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5693 -1.3062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1641 -0.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1641 -0.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5693 0.0674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1379 -0.9182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9745 1.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1641 1.3062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6641 2.1722 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 5 1 0 0 0 0
8 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
9 18 1 0 0 0 0
1 19 1 0 0 0 0
19 20 1 0 0 0 0
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 -2.1641 1.3062
S SKP 8
ID FLIA19NM0002
KNApSAcK_ID C00009381
NAME 7-Methoxy-2-methylisoflavone
CAS_RN 19725-44-1
FORMULA C17H14O3
EXACTMASS 266.09429431399997
AVERAGEMASS 266.29125999999997
SMILES COc(c3)cc(O1)c(c3)C(=O)C(c(c2)cccc2)=C(C)1
M END
