Mol:FLID1CNF0003
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 25 30 0 0 0 0 0 0 0 0999 V2000 | + | 25 30 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.0196 0.5497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0196 0.5497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0196 -0.0927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0196 -0.0927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4633 -0.4138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4633 -0.4138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9070 -0.0927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9070 -0.0927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9070 0.5497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9070 0.5497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4633 0.8709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4633 0.8709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3507 -0.4138 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | -0.3507 -0.4138 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | 0.2056 -0.0927 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 0.2056 -0.0927 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | 0.2056 0.5497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2056 0.5497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3507 0.8709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3507 0.8709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7617 -0.4137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7617 -0.4137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7617 -1.1005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7617 -1.1005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3565 -1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3565 -1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9512 -1.1005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9512 -1.1005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9512 -0.4137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9512 -0.4137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3565 -0.0703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3565 -0.0703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3449 -1.1003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3449 -1.1003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6306 0.7482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6306 0.7482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0081 0.2285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0081 0.2285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6306 -0.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6306 -0.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6044 -1.3128 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6044 -1.3128 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0081 -0.7571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0081 -0.7571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6044 -0.2015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6044 -0.2015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1853 1.4439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1853 1.4439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7488 2.3436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7488 2.3436 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 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 |
| − | 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 |
| − | 7 17 1 0 0 0 0 | + | 7 17 1 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 12 17 1 0 0 0 0 | + | 12 17 1 0 0 0 0 |
| − | 1 18 1 0 0 0 0 | + | 1 18 1 0 0 0 0 |
| − | 18 19 1 0 0 0 0 | + | 18 19 1 0 0 0 0 |
| − | 19 20 2 0 0 0 0 | + | 19 20 2 0 0 0 0 |
| − | 20 2 1 0 0 0 0 | + | 20 2 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 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | 23 15 1 0 0 0 0 | + | 23 15 1 0 0 0 0 |
| − | 6 24 1 0 0 0 0 | + | 6 24 1 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 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 24 25 | + | M SAL 1 2 24 25 |
| − | M SBL 1 1 29 | + | M SBL 1 1 29 |
| − | M SMT 1 OCH3 | + | M SMT 1 OCH3 |
| − | M SVB 1 29 -1.1853 1.4439 | + | M SVB 1 29 -1.1853 1.4439 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FLID1CNF0003 | + | ID FLID1CNF0003 |
| − | KNApSAcK_ID C00009646 | + | KNApSAcK_ID C00009646 |
| − | NAME Ficinin;4-Methoxyneodulin | + | NAME Ficinin;4-Methoxyneodulin |
| − | CAS_RN 10338-03-1 | + | CAS_RN 10338-03-1 |
| − | FORMULA C19H14O6 | + | FORMULA C19H14O6 |
| − | EXACTMASS 338.07903818 | + | EXACTMASS 338.07903818 |
| − | AVERAGEMASS 338.31086000000005 | + | AVERAGEMASS 338.31086000000005 |
| − | SMILES c(c56)c(O4)c(cc5OCO6)C(C41)COc(c3OC)c(cc(c32)cco2)1 | + | SMILES c(c56)c(O4)c(cc5OCO6)C(C41)COc(c3OC)c(cc(c32)cco2)1 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
25 30 0 0 0 0 0 0 0 0999 V2000
-2.0196 0.5497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0196 -0.0927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4633 -0.4138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9070 -0.0927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9070 0.5497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4633 0.8709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3507 -0.4138 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
0.2056 -0.0927 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
0.2056 0.5497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3507 0.8709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7617 -0.4137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7617 -1.1005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3565 -1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9512 -1.1005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9512 -0.4137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3565 -0.0703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3449 -1.1003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6306 0.7482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0081 0.2285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6306 -0.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6044 -1.3128 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0081 -0.7571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6044 -0.2015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1853 1.4439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7488 2.3436 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 1 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
7 17 1 0 0 0 0
1 2 1 0 0 0 0
12 17 1 0 0 0 0
1 18 1 0 0 0 0
18 19 1 0 0 0 0
19 20 2 0 0 0 0
20 2 1 0 0 0 0
14 21 1 0 0 0 0
21 22 1 0 0 0 0
22 23 1 0 0 0 0
23 15 1 0 0 0 0
6 24 1 0 0 0 0
24 25 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 24 25
M SBL 1 1 29
M SMT 1 OCH3
M SVB 1 29 -1.1853 1.4439
S SKP 8
ID FLID1CNF0003
KNApSAcK_ID C00009646
NAME Ficinin;4-Methoxyneodulin
CAS_RN 10338-03-1
FORMULA C19H14O6
EXACTMASS 338.07903818
AVERAGEMASS 338.31086000000005
SMILES c(c56)c(O4)c(cc5OCO6)C(C41)COc(c3OC)c(cc(c32)cco2)1
M END
