Mol:FL3FACNI0004
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 31 33 0 0 0 0 0 0 0 0999 V2000 | + | 31 33 0 0 0 0 0 0 0 0999 V2000 |
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| − | -1.0717 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0717 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7862 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7862 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5006 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5006 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5006 -1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5006 -1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7862 -2.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7862 -2.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3572 -2.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3572 -2.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3572 -1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3572 -1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3572 -1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3572 -1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3572 -0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3572 -0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0717 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0717 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7862 -1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7862 -1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5006 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5006 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5006 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5006 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7862 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7862 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0717 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0717 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3572 -3.0938 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3572 -3.0938 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2151 0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2151 0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2151 -0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2151 -0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7862 -3.0938 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7862 -3.0938 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2151 -1.0312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2151 -1.0312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7862 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7862 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5006 1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5006 1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5006 2.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5006 2.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7862 3.0938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7862 3.0938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2151 3.0938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2151 3.0938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | -2.5006 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5006 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | -3.2151 1.8562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2151 1.8562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7862 1.8562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7862 1.8562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | 3 4 2 0 0 0 0 | + | 3 4 2 0 0 0 0 |
| − | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
| − | 5 6 2 0 0 0 0 | + | 5 6 2 0 0 0 0 |
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| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 10 2 1 0 0 0 0 | + | 10 2 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 |
| − | 18 14 1 0 0 0 0 | + | 18 14 1 0 0 0 0 |
| − | 4 19 1 0 0 0 0 | + | 4 19 1 0 0 0 0 |
| − | 6 20 1 0 0 0 0 | + | 6 20 1 0 0 0 0 |
| − | 13 21 1 0 0 0 0 | + | 13 21 1 0 0 0 0 |
| − | 15 22 1 0 0 0 0 | + | 15 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 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 24 26 1 0 0 0 0 | + | 24 26 1 0 0 0 0 |
| − | 3 27 1 0 0 0 0 | + | 3 27 1 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | 28 29 2 0 0 0 0 | + | 28 29 2 0 0 0 0 |
| − | 29 30 1 0 0 0 0 | + | 29 30 1 0 0 0 0 |
| − | 29 31 1 0 0 0 0 | + | 29 31 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FACNI0004 | + | ID FL3FACNI0004 |
| − | KNApSAcK_ID C00013420 | + | KNApSAcK_ID C00013420 |
| − | NAME Epimedokoreanin B;2-[3,4-Dihydroxy-5-(3-methyl-2-butenyl)phenyl]-5,7-dihydroxy-8-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one | + | NAME Epimedokoreanin B;2-[3,4-Dihydroxy-5-(3-methyl-2-butenyl)phenyl]-5,7-dihydroxy-8-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one |
| − | CAS_RN 161068-53-7 | + | CAS_RN 161068-53-7 |
| − | FORMULA C25H26O6 | + | FORMULA C25H26O6 |
| − | EXACTMASS 422.172938564 | + | EXACTMASS 422.172938564 |
| − | AVERAGEMASS 422.47033999999996 | + | AVERAGEMASS 422.47033999999996 |
| − | SMILES C(=C(C)C)Cc(c1)c(c(O)cc1C(=C3)Oc(c(C(=O)3)2)c(c(O)cc2O)CC=C(C)C)O | + | SMILES C(=C(C)C)Cc(c1)c(c(O)cc1C(=C3)Oc(c(C(=O)3)2)c(c(O)cc2O)CC=C(C)C)O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
31 33 0 0 0 0 0 0 0 0999 V2000
-1.0717 -1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0717 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7862 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5006 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5006 -1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7862 -2.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 -2.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3572 -1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3572 -1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 -0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7862 -1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7862 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 -3.0938 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2151 0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2151 -0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7862 -3.0938 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2151 -1.0312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7862 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 2.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7862 3.0938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2151 3.0938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7862 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5006 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5006 1.4437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2151 1.8562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7862 1.8562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
2 3 1 0 0 0 0
3 4 2 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
6 1 1 0 0 0 0
1 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 2 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
18 14 1 0 0 0 0
4 19 1 0 0 0 0
6 20 1 0 0 0 0
13 21 1 0 0 0 0
15 22 1 0 0 0 0
22 23 1 0 0 0 0
23 24 2 0 0 0 0
24 25 1 0 0 0 0
24 26 1 0 0 0 0
3 27 1 0 0 0 0
27 28 1 0 0 0 0
28 29 2 0 0 0 0
29 30 1 0 0 0 0
29 31 1 0 0 0 0
S SKP 8
ID FL3FACNI0004
KNApSAcK_ID C00013420
NAME Epimedokoreanin B;2-[3,4-Dihydroxy-5-(3-methyl-2-butenyl)phenyl]-5,7-dihydroxy-8-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one
CAS_RN 161068-53-7
FORMULA C25H26O6
EXACTMASS 422.172938564
AVERAGEMASS 422.47033999999996
SMILES C(=C(C)C)Cc(c1)c(c(O)cc1C(=C3)Oc(c(C(=O)3)2)c(c(O)cc2O)CC=C(C)C)O
M END
