Mol:FLIE1ANP0001
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 29 0 0 0 0 0 0 0 0999 V2000 | + | 25 29 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.6629 1.6219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6629 1.6219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6629 1.0441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6629 1.0441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1624 0.7551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1624 0.7551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6620 1.0441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6620 1.0441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6620 1.6219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6620 1.6219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1624 1.9109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1624 1.9109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1615 0.7551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1615 0.7551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3389 1.0441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3389 1.0441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3389 1.6219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3389 1.6219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1615 1.9109 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1615 1.9109 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1040 1.8766 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1040 1.8766 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0414 0.1899 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0414 0.1899 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5333 0.1295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5333 0.1295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7684 0.6574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7684 0.6574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6170 1.9000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6170 1.9000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8730 -0.3380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8730 -0.3380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4477 -0.2776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4477 -0.2776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6827 0.2503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6827 0.2503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3431 0.7178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3431 0.7178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6380 -0.8659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6380 -0.8659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9776 -1.3334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9776 -1.3334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5523 -1.2730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5523 -1.2730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7874 -0.7451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7874 -0.7451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7232 -1.9109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7232 -1.9109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1040 -1.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1040 -1.4208 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 2 0 0 0 0 | + | 7 8 2 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 |
| − | 1 11 1 0 0 0 0 | + | 1 11 1 0 0 0 0 |
| − | 7 12 1 0 0 0 0 | + | 7 12 1 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 8 1 0 0 0 0 | + | 14 8 1 0 0 0 0 |
| − | 9 15 2 0 0 0 0 | + | 9 15 2 0 0 0 0 |
| − | 13 16 1 0 0 0 0 | + | 13 16 1 0 0 0 0 |
| − | 16 17 2 0 0 0 0 | + | 16 17 2 0 0 0 0 |
| − | 17 18 1 0 0 0 0 | + | 17 18 1 0 0 0 0 |
| − | 18 19 2 0 0 0 0 | + | 18 19 2 0 0 0 0 |
| − | 19 14 1 0 0 0 0 | + | 19 14 1 0 0 0 0 |
| − | 16 20 1 0 0 0 0 | + | 16 20 1 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 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 17 1 0 0 0 0 | + | 23 17 1 0 0 0 0 |
| − | 22 24 1 1 0 0 0 | + | 22 24 1 1 0 0 0 |
| − | 22 25 1 6 0 0 0 | + | 22 25 1 6 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FLIE1ANP0001 | + | ID FLIE1ANP0001 |
| − | KNApSAcK_ID C00002572 | + | KNApSAcK_ID C00002572 |
| − | NAME Sojagol;Soyagol | + | NAME Sojagol;Soyagol |
| − | CAS_RN 18979-00-5 | + | CAS_RN 18979-00-5 |
| − | FORMULA C20H16O5 | + | FORMULA C20H16O5 |
| − | EXACTMASS 336.099773622 | + | EXACTMASS 336.099773622 |
| − | AVERAGEMASS 336.33804000000003 | + | AVERAGEMASS 336.33804000000003 |
| − | SMILES c(O)(c5)ccc(c51)c(o4)c(c(c42)ccc(O3)c2CCC(C)(C)3)C(=O)O1 | + | SMILES c(O)(c5)ccc(c51)c(o4)c(c(c42)ccc(O3)c2CCC(C)(C)3)C(=O)O1 |
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 29 0 0 0 0 0 0 0 0999 V2000
-1.6629 1.6219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6629 1.0441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1624 0.7551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6620 1.0441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6620 1.6219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1624 1.9109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1615 0.7551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3389 1.0441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3389 1.6219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1615 1.9109 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1040 1.8766 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0414 0.1899 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5333 0.1295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7684 0.6574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6170 1.9000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8730 -0.3380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4477 -0.2776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6827 0.2503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3431 0.7178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6380 -0.8659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9776 -1.3334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5523 -1.2730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7874 -0.7451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7232 -1.9109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1040 -1.4208 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 2 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
1 11 1 0 0 0 0
7 12 1 0 0 0 0
12 13 1 0 0 0 0
13 14 2 0 0 0 0
14 8 1 0 0 0 0
9 15 2 0 0 0 0
13 16 1 0 0 0 0
16 17 2 0 0 0 0
17 18 1 0 0 0 0
18 19 2 0 0 0 0
19 14 1 0 0 0 0
16 20 1 0 0 0 0
20 21 1 0 0 0 0
21 22 1 0 0 0 0
22 23 1 0 0 0 0
23 17 1 0 0 0 0
22 24 1 1 0 0 0
22 25 1 6 0 0 0
S SKP 8
ID FLIE1ANP0001
KNApSAcK_ID C00002572
NAME Sojagol;Soyagol
CAS_RN 18979-00-5
FORMULA C20H16O5
EXACTMASS 336.099773622
AVERAGEMASS 336.33804000000003
SMILES c(O)(c5)ccc(c51)c(o4)c(c(c42)ccc(O3)c2CCC(C)(C)3)C(=O)O1
M END
