Mol:FLIA1ANP0002
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 |
| − | -1.4288 0.7285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4288 0.7285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4288 0.0861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4288 0.0861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8725 -0.2351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8725 -0.2351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3162 0.0861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3162 0.0861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3162 0.7285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3162 0.7285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8725 1.0497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8725 1.0497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2401 -0.2351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2401 -0.2351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7964 0.0861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7964 0.0861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7964 0.7285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7964 0.7285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2401 1.0497 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2401 1.0497 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3525 -0.2349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3525 -0.2349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3525 -0.9217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3525 -0.9217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9473 -1.2651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9473 -1.2651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5421 -0.9217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5421 -0.9217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5421 -0.2349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5421 -0.2349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9473 0.1085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9473 0.1085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2401 -0.8772 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2401 -0.8772 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1368 -1.2651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1368 -1.2651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9851 1.0497 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9851 1.0497 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5414 0.7285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5414 0.7285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5414 0.0861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5414 0.0861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9851 -0.2351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9851 -0.2351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8513 1.2651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8513 1.2651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1368 0.5689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1368 0.5689 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 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 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 |
| − | 18 14 1 0 0 0 0 | + | 18 14 1 0 0 0 0 |
| − | 1 19 1 0 0 0 0 | + | 1 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 22 2 0 0 0 0 | + | 21 22 2 0 0 0 0 |
| − | 22 2 1 0 0 0 0 | + | 22 2 1 0 0 0 0 |
| − | 20 23 1 0 0 0 0 | + | 20 23 1 0 0 0 0 |
| − | 20 24 1 0 0 0 0 | + | 20 24 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FLIA1ANP0002 | + | ID FLIA1ANP0002 |
| − | KNApSAcK_ID C00009431 | + | KNApSAcK_ID C00009431 |
| − | NAME Erythrinin A | + | NAME Erythrinin A |
| − | CAS_RN 63807-86-3 | + | CAS_RN 63807-86-3 |
| − | FORMULA C20H16O4 | + | FORMULA C20H16O4 |
| − | EXACTMASS 320.104859 | + | EXACTMASS 320.104859 |
| − | AVERAGEMASS 320.33864 | + | AVERAGEMASS 320.33864 |
| − | SMILES Oc(c1)ccc(C(C(=O)4)=COc(c43)cc(c2c3)OC(C=C2)(C)C)c1 | + | SMILES Oc(c1)ccc(C(C(=O)4)=COc(c43)cc(c2c3)OC(C=C2)(C)C)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
-1.4288 0.7285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4288 0.0861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8725 -0.2351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3162 0.0861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3162 0.7285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8725 1.0497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2401 -0.2351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7964 0.0861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7964 0.7285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2401 1.0497 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3525 -0.2349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3525 -0.9217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9473 -1.2651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5421 -0.9217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5421 -0.2349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9473 0.1085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2401 -0.8772 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1368 -1.2651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9851 1.0497 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5414 0.7285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5414 0.0861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9851 -0.2351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8513 1.2651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1368 0.5689 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 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 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
18 14 1 0 0 0 0
1 19 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 2 1 0 0 0 0
20 23 1 0 0 0 0
20 24 1 0 0 0 0
S SKP 8
ID FLIA1ANP0002
KNApSAcK_ID C00009431
NAME Erythrinin A
CAS_RN 63807-86-3
FORMULA C20H16O4
EXACTMASS 320.104859
AVERAGEMASS 320.33864
SMILES Oc(c1)ccc(C(C(=O)4)=COc(c43)cc(c2c3)OC(C=C2)(C)C)c1
M END
