Mol:FL2FCDNI0002
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 28 30 0 0 0 0 0 0 0 0999 V2000 | + | 28 30 0 0 0 0 0 0 0 0999 V2000 |
| − | -3.2135 -0.3666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2135 -0.3666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2135 -1.0089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2135 -1.0089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6572 -1.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6572 -1.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1009 -1.0089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1009 -1.0089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1009 -0.3666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1009 -0.3666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6572 -0.0454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6572 -0.0454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5446 -1.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5446 -1.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9883 -1.0089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9883 -1.0089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9883 -0.3666 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | -0.9883 -0.3666 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | -1.5446 -0.0454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5446 -0.0454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4322 -0.0455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4322 -0.0455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1348 -0.3729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1348 -0.3729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7018 -0.0455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7018 -0.0455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7018 0.6092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7018 0.6092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1348 0.9365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1348 0.9365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4322 0.6092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4322 0.6092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5446 -1.8739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5446 -1.8739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6572 -1.9723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6572 -1.9723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3278 0.4178 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3278 0.4178 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1520 0.5631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1520 0.5631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2847 -0.1894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2847 -0.1894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0778 -0.0495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0778 -0.0495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2689 0.4757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2689 0.4757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3436 -0.6196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3436 -0.6196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.5707 0.2522 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5707 0.2522 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.0706 1.1183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.0706 1.1183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4182 1.5126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4182 1.5126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1327 1.1001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1327 1.1001 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 |
| − | 19 14 1 0 0 0 0 | + | 19 14 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 22 2 0 0 0 0 | + | 21 22 2 0 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | 22 24 1 0 0 0 0 | + | 22 24 1 0 0 0 0 |
| − | 1 25 1 0 0 0 0 | + | 1 25 1 0 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 15 27 1 0 0 0 0 | + | 15 27 1 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 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 27 28 | + | M SAL 2 2 27 28 |
| − | M SBL 2 1 29 | + | M SBL 2 1 29 |
| − | M SMT 2 OCH3 | + | M SMT 2 OCH3 |
| − | M SVB 2 29 0.4182 1.5126 | + | M SVB 2 29 0.4182 1.5126 |
| − | M STY 1 1 SUP | + | M STY 1 1 SUP |
| − | M SLB 1 1 1 | + | M SLB 1 1 1 |
| − | M SAL 1 2 25 26 | + | M SAL 1 2 25 26 |
| − | M SBL 1 1 27 | + | M SBL 1 1 27 |
| − | M SMT 1 OCH3 | + | M SMT 1 OCH3 |
| − | M SVB 1 27 -3.5707 0.2522 | + | M SVB 1 27 -3.5707 0.2522 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FCDNI0002 | + | ID FL2FCDNI0002 |
| − | KNApSAcK_ID C00008350 | + | KNApSAcK_ID C00008350 |
| − | NAME Eriodictyol 7,3'-dimethyl ether 4'-prenyl ether | + | NAME Eriodictyol 7,3'-dimethyl ether 4'-prenyl ether |
| − | CAS_RN 39953-50-9 | + | CAS_RN 39953-50-9 |
| − | FORMULA C22H24O6 | + | FORMULA C22H24O6 |
| − | EXACTMASS 384.1572885 | + | EXACTMASS 384.1572885 |
| − | AVERAGEMASS 384.42236 | + | AVERAGEMASS 384.42236 |
| − | SMILES c(c(C(O3)CC(c(c23)c(cc(c2)OC)O)=O)1)c(OC)c(OCC=C(C)C)cc1 | + | SMILES c(c(C(O3)CC(c(c23)c(cc(c2)OC)O)=O)1)c(OC)c(OCC=C(C)C)cc1 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
28 30 0 0 0 0 0 0 0 0999 V2000
-3.2135 -0.3666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2135 -1.0089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6572 -1.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1009 -1.0089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1009 -0.3666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6572 -0.0454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5446 -1.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9883 -1.0089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9883 -0.3666 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
-1.5446 -0.0454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4322 -0.0455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1348 -0.3729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7018 -0.0455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7018 0.6092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1348 0.9365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4322 0.6092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5446 -1.8739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6572 -1.9723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3278 0.4178 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1520 0.5631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2847 -0.1894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0778 -0.0495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2689 0.4757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3436 -0.6196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5707 0.2522 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.0706 1.1183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4182 1.5126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1327 1.1001 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
19 14 1 0 0 0 0
19 20 1 0 0 0 0
20 21 1 0 0 0 0
21 22 2 0 0 0 0
22 23 1 0 0 0 0
22 24 1 0 0 0 0
1 25 1 0 0 0 0
25 26 1 0 0 0 0
15 27 1 0 0 0 0
27 28 1 0 0 0 0
M STY 1 2 SUP
M SLB 1 2 2
M SAL 2 2 27 28
M SBL 2 1 29
M SMT 2 OCH3
M SVB 2 29 0.4182 1.5126
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 25 26
M SBL 1 1 27
M SMT 1 OCH3
M SVB 1 27 -3.5707 0.2522
S SKP 8
ID FL2FCDNI0002
KNApSAcK_ID C00008350
NAME Eriodictyol 7,3'-dimethyl ether 4'-prenyl ether
CAS_RN 39953-50-9
FORMULA C22H24O6
EXACTMASS 384.1572885
AVERAGEMASS 384.42236
SMILES c(c(C(O3)CC(c(c23)c(cc(c2)OC)O)=O)1)c(OC)c(OCC=C(C)C)cc1
M END
