Mol:FL5FACNI0002
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 27 29 0 0 0 0 0 0 0 0999 V2000 | + | 27 29 0 0 0 0 0 0 0 0999 V2000 |
| − | -3.0354 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0354 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0354 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0354 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4791 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4791 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9228 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9228 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9228 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9228 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4791 0.1452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4791 0.1452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3665 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3665 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8102 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8102 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8102 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8102 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3665 0.1452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3665 0.1452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3665 -1.6403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3665 -1.6403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2541 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2541 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3129 -0.1822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3129 -0.1822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8799 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8799 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8799 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8799 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3129 1.1271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3129 1.1271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2541 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2541 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2304 -1.1247 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2304 -1.1247 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4791 -1.7816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4791 -1.7816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4467 1.1270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4467 1.1270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5792 -0.2102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5792 -0.2102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.5915 0.1451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5915 0.1451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3129 1.7816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3129 1.7816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2360 0.2175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2360 0.2175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9347 -0.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9347 -0.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5915 0.2902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5915 0.2902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9767 -0.9201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9767 -0.9201 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 |
| − | 7 11 2 0 0 0 0 | + | 7 11 2 0 0 0 0 |
| − | 9 12 1 0 0 0 0 | + | 9 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 17 2 0 0 0 0 | + | 16 17 2 0 0 0 0 |
| − | 17 12 1 0 0 0 0 | + | 17 12 1 0 0 0 0 |
| − | 8 18 1 0 0 0 0 | + | 8 18 1 0 0 0 0 |
| − | 3 19 1 0 0 0 0 | + | 3 19 1 0 0 0 0 |
| − | 15 20 1 0 0 0 0 | + | 15 20 1 0 0 0 0 |
| − | 21 14 1 0 0 0 0 | + | 21 14 1 0 0 0 0 |
| − | 1 22 1 0 0 0 0 | + | 1 22 1 0 0 0 0 |
| − | 16 23 1 0 0 0 0 | + | 16 23 1 0 0 0 0 |
| − | 21 24 1 0 0 0 0 | + | 21 24 1 0 0 0 0 |
| − | 24 25 2 0 0 0 0 | + | 24 25 2 0 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 25 27 1 0 0 0 0 | + | 25 27 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL5FACNI0002 | + | ID FL5FACNI0002 |
| − | KNApSAcK_ID C00005031 | + | KNApSAcK_ID C00005031 |
| − | NAME Uralenol;2-[3,4-Dihydroxy-5-(3-methyl-2-butenyl)phenyl]-3,5,7-trihydroxy-4H-1-benzopyran-4-one | + | NAME Uralenol;2-[3,4-Dihydroxy-5-(3-methyl-2-butenyl)phenyl]-3,5,7-trihydroxy-4H-1-benzopyran-4-one |
| − | CAS_RN 139163-15-8 | + | CAS_RN 139163-15-8 |
| − | FORMULA C20H18O7 | + | FORMULA C20H18O7 |
| − | EXACTMASS 370.10525293 | + | EXACTMASS 370.10525293 |
| − | AVERAGEMASS 370.35272 | + | AVERAGEMASS 370.35272 |
| − | SMILES c(c(O)3)c(O)c(C2=O)c(c3)OC(=C2O)c(c1)cc(c(O)c(O)1)CC=C(C)C | + | SMILES c(c(O)3)c(O)c(C2=O)c(c3)OC(=C2O)c(c1)cc(c(O)c(O)1)CC=C(C)C |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
27 29 0 0 0 0 0 0 0 0999 V2000
-3.0354 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0354 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4791 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9228 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9228 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4791 0.1452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3665 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8102 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8102 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3665 0.1452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3665 -1.6403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2541 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3129 -0.1822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8799 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8799 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3129 1.1271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2541 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2304 -1.1247 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4791 -1.7816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4467 1.1270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5792 -0.2102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5915 0.1451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3129 1.7816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2360 0.2175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9347 -0.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5915 0.2902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9767 -0.9201 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
7 11 2 0 0 0 0
9 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 17 2 0 0 0 0
17 12 1 0 0 0 0
8 18 1 0 0 0 0
3 19 1 0 0 0 0
15 20 1 0 0 0 0
21 14 1 0 0 0 0
1 22 1 0 0 0 0
16 23 1 0 0 0 0
21 24 1 0 0 0 0
24 25 2 0 0 0 0
25 26 1 0 0 0 0
25 27 1 0 0 0 0
S SKP 8
ID FL5FACNI0002
KNApSAcK_ID C00005031
NAME Uralenol;2-[3,4-Dihydroxy-5-(3-methyl-2-butenyl)phenyl]-3,5,7-trihydroxy-4H-1-benzopyran-4-one
CAS_RN 139163-15-8
FORMULA C20H18O7
EXACTMASS 370.10525293
AVERAGEMASS 370.35272
SMILES c(c(O)3)c(O)c(C2=O)c(c3)OC(=C2O)c(c1)cc(c(O)c(O)1)CC=C(C)C
M END
