Mol:FL3FECNSS002
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 |
| − | -1.0888 -0.1647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0888 -0.1647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0888 -0.6856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0888 -0.6856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6377 -0.9460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6377 -0.9460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1866 -0.6856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1866 -0.6856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1866 -0.1647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1866 -0.1647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6377 0.0957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6377 0.0957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2644 -0.9460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2644 -0.9460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7155 -0.6856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7155 -0.6856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7155 -0.1647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7155 -0.1647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2644 0.0957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2644 0.0957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2644 -1.3521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2644 -1.3521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1664 0.0956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1664 0.0956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6261 -0.1698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6261 -0.1698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0858 0.0956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0858 0.0956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0858 0.6264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0858 0.6264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6261 0.8919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6261 0.8919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1664 0.6264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1664 0.6264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6261 1.4956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6261 1.4956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6760 0.9672 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6760 0.9672 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6377 -1.4658 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6377 -1.4658 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5389 0.0951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5389 0.0951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5389 -0.9455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5389 -0.9455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1604 -0.9455 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1604 -0.9455 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1604 -0.4635 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1604 -0.4635 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6760 -0.9455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6760 -0.9455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1604 -1.4956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1604 -1.4956 0.0000 O 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 |
| − | 7 11 2 0 0 0 0 | + | 7 11 2 0 0 0 0 |
| − | 9 12 1 0 0 0 0 | + | 9 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 |
| − | 16 18 1 0 0 0 0 | + | 16 18 1 0 0 0 0 |
| − | 19 15 1 0 0 0 0 | + | 19 15 1 0 0 0 0 |
| − | 3 20 1 0 0 0 0 | + | 3 20 1 0 0 0 0 |
| − | 1 21 1 0 0 0 0 | + | 1 21 1 0 0 0 0 |
| − | 2 22 1 0 0 0 0 | + | 2 22 1 0 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | 23 24 2 0 0 0 0 | + | 23 24 2 0 0 0 0 |
| − | 23 25 1 0 0 0 0 | + | 23 25 1 0 0 0 0 |
| − | 23 26 2 0 0 0 0 | + | 23 26 2 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FECNSS002 | + | ID FL3FECNSS002 |
| − | KNApSAcK_ID C00004398 | + | KNApSAcK_ID C00004398 |
| − | NAME 6-Hydroxyluteolin 6-sulfate | + | NAME 6-Hydroxyluteolin 6-sulfate |
| − | CAS_RN 111509-44-5 | + | CAS_RN 111509-44-5 |
| − | FORMULA C15H10O10S | + | FORMULA C15H10O10S |
| − | EXACTMASS 381.99946723 | + | EXACTMASS 381.99946723 |
| − | AVERAGEMASS 382.2999 | + | AVERAGEMASS 382.2999 |
| − | SMILES Oc(c3)c(O)cc(c3)C(=C2)Oc(c1)c(C(=O)2)c(O)c(c(O)1)OS(O)(=O)=O | + | SMILES Oc(c3)c(O)cc(c3)C(=C2)Oc(c1)c(C(=O)2)c(O)c(c(O)1)OS(O)(=O)=O |
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
-1.0888 -0.1647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0888 -0.6856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6377 -0.9460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1866 -0.6856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1866 -0.1647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6377 0.0957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2644 -0.9460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7155 -0.6856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7155 -0.1647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2644 0.0957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2644 -1.3521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1664 0.0956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6261 -0.1698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0858 0.0956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0858 0.6264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6261 0.8919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1664 0.6264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6261 1.4956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6760 0.9672 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6377 -1.4658 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5389 0.0951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5389 -0.9455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1604 -0.9455 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
-2.1604 -0.4635 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6760 -0.9455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1604 -1.4956 0.0000 O 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
7 11 2 0 0 0 0
9 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
16 18 1 0 0 0 0
19 15 1 0 0 0 0
3 20 1 0 0 0 0
1 21 1 0 0 0 0
2 22 1 0 0 0 0
22 23 1 0 0 0 0
23 24 2 0 0 0 0
23 25 1 0 0 0 0
23 26 2 0 0 0 0
S SKP 8
ID FL3FECNSS002
KNApSAcK_ID C00004398
NAME 6-Hydroxyluteolin 6-sulfate
CAS_RN 111509-44-5
FORMULA C15H10O10S
EXACTMASS 381.99946723
AVERAGEMASS 382.2999
SMILES Oc(c3)c(O)cc(c3)C(=C2)Oc(c1)c(C(=O)2)c(O)c(c(O)1)OS(O)(=O)=O
M END
