Mol:FL2FAANP0015
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 30 0 0 0 0 0 0 0 0999 V2000 | + | 27 30 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.8295 0.1202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8295 0.1202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8109 -0.6836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8109 -0.6836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0338 -1.0688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0338 -1.0688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3789 -0.6677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3789 -0.6677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3648 0.1572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3648 0.1572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0904 0.5822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0904 0.5822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3760 -1.0932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3760 -1.0932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0498 -0.6923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0498 -0.6923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0406 0.1741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0406 0.1741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3567 0.5573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3567 0.5573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7550 0.5866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7550 0.5866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4461 0.2001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4461 0.2001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1535 0.5919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1535 0.5919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1825 1.4154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1825 1.4154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4662 1.8532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4662 1.8532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7458 1.4530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7458 1.4530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3760 -1.8349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3760 -1.8349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8969 1.8279 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8969 1.8279 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0338 -1.8532 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0338 -1.8532 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0904 1.3503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0904 1.3503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6950 1.6993 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6950 1.6993 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5349 0.5061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5349 0.5061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2218 0.0881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2218 0.0881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2032 -0.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2032 -0.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4978 -1.1016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4978 -1.1016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6725 0.5388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6725 0.5388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.8969 -0.3017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8969 -0.3017 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 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 |
| − | 9 11 1 6 0 0 0 | + | 9 11 1 6 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 |
| − | 3 19 1 0 0 0 0 | + | 3 19 1 0 0 0 0 |
| − | 6 20 1 0 0 0 0 | + | 6 20 1 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 1 22 1 0 0 0 0 | + | 1 22 1 0 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
| − | 24 25 2 0 0 0 0 | + | 24 25 2 0 0 0 0 |
| − | 25 2 1 0 0 0 0 | + | 25 2 1 0 0 0 0 |
| − | 23 26 1 0 0 0 0 | + | 23 26 1 0 0 0 0 |
| − | 23 27 1 0 0 0 0 | + | 23 27 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FAANP0015 | + | ID FL2FAANP0015 |
| − | KNApSAcK_ID C00014242 | + | KNApSAcK_ID C00014242 |
| − | NAME (2S)-4',5-Dihydroxy-8-hydroxymethyl-6'',6''-dimethylpyrano[2'',3'':7,6]flavanone | + | NAME (2S)-4',5-Dihydroxy-8-hydroxymethyl-6'',6''-dimethylpyrano[2'',3'':7,6]flavanone |
| − | CAS_RN 466689-44-1 | + | CAS_RN 466689-44-1 |
| − | FORMULA C21H20O6 | + | FORMULA C21H20O6 |
| − | EXACTMASS 368.125988372 | + | EXACTMASS 368.125988372 |
| − | AVERAGEMASS 368.37989999999996 | + | AVERAGEMASS 368.37989999999996 |
| − | SMILES O(c24)C(CC(c2c(O)c(c3c(CO)4)C=CC(C)(C)O3)=O)c(c1)ccc(O)c1 | + | SMILES O(c24)C(CC(c2c(O)c(c3c(CO)4)C=CC(C)(C)O3)=O)c(c1)ccc(O)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/
27 30 0 0 0 0 0 0 0 0999 V2000
-1.8295 0.1202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8109 -0.6836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0338 -1.0688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3789 -0.6677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3648 0.1572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0904 0.5822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3760 -1.0932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0498 -0.6923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0406 0.1741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3567 0.5573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7550 0.5866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4461 0.2001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1535 0.5919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1825 1.4154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4662 1.8532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7458 1.4530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3760 -1.8349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8969 1.8279 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0338 -1.8532 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0904 1.3503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6950 1.6993 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5349 0.5061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2218 0.0881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2032 -0.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4978 -1.1016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6725 0.5388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8969 -0.3017 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 1 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
9 11 1 6 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
3 19 1 0 0 0 0
6 20 1 0 0 0 0
20 21 1 0 0 0 0
1 22 1 0 0 0 0
22 23 1 0 0 0 0
23 24 1 0 0 0 0
24 25 2 0 0 0 0
25 2 1 0 0 0 0
23 26 1 0 0 0 0
23 27 1 0 0 0 0
S SKP 8
ID FL2FAANP0015
KNApSAcK_ID C00014242
NAME (2S)-4',5-Dihydroxy-8-hydroxymethyl-6'',6''-dimethylpyrano[2'',3'':7,6]flavanone
CAS_RN 466689-44-1
FORMULA C21H20O6
EXACTMASS 368.125988372
AVERAGEMASS 368.37989999999996
SMILES O(c24)C(CC(c2c(O)c(c3c(CO)4)C=CC(C)(C)O3)=O)c(c1)ccc(O)c1
M END
