Mol:FLIAECNS0009
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 24 27 0 0 0 0 0 0 0 0999 V2000 | + | 24 27 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.1566 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1566 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1566 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1566 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6003 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6003 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0440 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0440 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0440 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0440 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6003 1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6003 1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4877 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4877 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0686 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0686 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0686 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0686 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4877 1.1574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4877 1.1574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6247 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6247 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6247 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6247 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2194 -1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2194 -1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8142 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8142 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8142 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8142 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2194 0.2162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2194 0.2162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7127 1.1573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7127 1.1573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4877 -0.7727 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4877 -0.7727 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4674 -1.0262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4674 -1.0262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8711 -0.4706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8711 -0.4706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4674 0.0850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4674 0.0850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6003 -0.7694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6003 -0.7694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8711 0.2853 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8711 0.2853 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1566 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1566 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 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 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 11 2 0 0 0 0 | + | 16 11 2 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 1 17 1 0 0 0 0 | + | 1 17 1 0 0 0 0 |
| − | 7 18 2 0 0 0 0 | + | 7 18 2 0 0 0 0 |
| − | 14 19 1 0 0 0 0 | + | 14 19 1 0 0 0 0 |
| − | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 21 15 1 0 0 0 0 | + | 21 15 1 0 0 0 0 |
| − | 3 22 1 0 0 0 0 | + | 3 22 1 0 0 0 0 |
| − | 2 23 1 0 0 0 0 | + | 2 23 1 0 0 0 0 |
| − | 23 24 1 0 0 0 0 | + | 23 24 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 23 24 | + | M SAL 1 2 23 24 |
| − | M SBL 1 1 26 | + | M SBL 1 1 26 |
| − | M SMT 1 ^OCH3 | + | M SMT 1 ^OCH3 |
| − | M SBV 1 26 -6.2289 5.1145 | + | M SBV 1 26 -6.2289 5.1145 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FLIAECNS0009 | + | ID FLIAECNS0009 |
| − | KNApSAcK_ID C00009828 | + | KNApSAcK_ID C00009828 |
| − | NAME Dalspinin;5,7-Dihydroxy-6-methoxy-3',4'-methylenedioxyisoflavone | + | NAME Dalspinin;5,7-Dihydroxy-6-methoxy-3',4'-methylenedioxyisoflavone |
| − | CAS_RN 83162-85-0 | + | CAS_RN 83162-85-0 |
| − | FORMULA C17H12O7 | + | FORMULA C17H12O7 |
| − | EXACTMASS 328.058302738 | + | EXACTMASS 328.058302738 |
| − | AVERAGEMASS 328.27297999999996 | + | AVERAGEMASS 328.27297999999996 |
| − | SMILES COc(c(O)4)c(O)c(c3c4)C(=O)C(=CO3)c(c1)cc(O2)c(OC2)c1 | + | SMILES COc(c(O)4)c(O)c(c3c4)C(=O)C(=CO3)c(c1)cc(O2)c(OC2)c1 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
24 27 0 0 0 0 0 0 0 0999 V2000
-2.1566 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1566 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6003 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0440 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0440 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6003 1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4877 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0686 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0686 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4877 1.1574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6247 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6247 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2194 -1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8142 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8142 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2194 0.2162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7127 1.1573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4877 -0.7727 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4674 -1.0262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8711 -0.4706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4674 0.0850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6003 -0.7694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8711 0.2853 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1566 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 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 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 11 2 0 0 0 0
1 2 1 0 0 0 0
1 17 1 0 0 0 0
7 18 2 0 0 0 0
14 19 1 0 0 0 0
19 20 1 0 0 0 0
20 21 1 0 0 0 0
21 15 1 0 0 0 0
3 22 1 0 0 0 0
2 23 1 0 0 0 0
23 24 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 23 24
M SBL 1 1 26
M SMT 1 ^OCH3
M SBV 1 26 -6.2289 5.1145
S SKP 8
ID FLIAECNS0009
KNApSAcK_ID C00009828
NAME Dalspinin;5,7-Dihydroxy-6-methoxy-3',4'-methylenedioxyisoflavone
CAS_RN 83162-85-0
FORMULA C17H12O7
EXACTMASS 328.058302738
AVERAGEMASS 328.27297999999996
SMILES COc(c(O)4)c(O)c(c3c4)C(=O)C(=CO3)c(c1)cc(O2)c(OC2)c1
M END
