Mol:FL2FAANP0019
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 32 35 0 0 0 0 0 0 0 0999 V2000 | + | 32 35 0 0 0 0 0 0 0 0999 V2000 |
| − | -0.3422 -1.3985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3422 -1.3985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3280 -0.5736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3280 -0.5736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4128 -1.8240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4128 -1.8240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0866 -1.4231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0866 -1.4231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0773 -0.5567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0773 -0.5567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3935 -0.1735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3935 -0.1735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7918 -0.1442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7918 -0.1442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4128 -2.5657 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4128 -2.5657 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5063 -0.5567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5063 -0.5567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2208 -0.1442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2208 -0.1442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2208 0.6808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2208 0.6808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5063 1.0933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5063 1.0933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7918 0.6808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7918 0.6808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0353 -0.1489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0353 -0.1489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7567 -0.5491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7567 -0.5491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7567 -1.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7567 -1.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0353 -1.7987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0353 -1.7987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0353 -2.5827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0353 -2.5827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8460 1.0418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8460 1.0418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4711 -0.1366 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4711 -0.1366 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1855 -0.5491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1855 -0.5491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1855 -1.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1855 -1.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4711 -1.7864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4711 -1.7864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.7638 -0.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.7638 -0.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.8460 -0.9304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8460 -0.9304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0353 0.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0353 0.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7497 0.9825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7497 0.9825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4642 0.5700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4642 0.5700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7497 1.8075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7497 1.8075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0353 2.2200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0353 2.2200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5622 1.6642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5622 1.6642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0319 2.5827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0319 2.5827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 2 0 0 0 0 | + | 1 2 2 0 0 0 0 |
| − | 1 3 1 0 0 0 0 | + | 1 3 1 0 0 0 0 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 6 2 1 0 0 0 0 | + | 6 2 1 0 0 0 0 |
| − | 5 7 1 6 0 0 0 | + | 5 7 1 6 0 0 0 |
| − | 3 8 2 0 0 0 0 | + | 3 8 2 0 0 0 0 |
| − | 7 9 2 0 0 0 0 | + | 7 9 2 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 10 11 2 0 0 0 0 | + | 10 11 2 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 12 13 2 0 0 0 0 | + | 12 13 2 0 0 0 0 |
| − | 13 7 1 0 0 0 0 | + | 13 7 1 0 0 0 0 |
| − | 2 14 1 0 0 0 0 | + | 2 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 1 1 0 0 0 0 | + | 17 1 1 0 0 0 0 |
| − | 17 18 1 0 0 0 0 | + | 17 18 1 0 0 0 0 |
| − | 11 19 1 0 0 0 0 | + | 11 19 1 0 0 0 0 |
| − | 15 20 1 0 0 0 0 | + | 15 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 2 0 0 0 0 | + | 22 23 2 0 0 0 0 |
| − | 23 16 1 0 0 0 0 | + | 23 16 1 0 0 0 0 |
| − | 21 24 1 0 0 0 0 | + | 21 24 1 0 0 0 0 |
| − | 21 25 1 0 0 0 0 | + | 21 25 1 0 0 0 0 |
| − | 14 26 1 0 0 0 0 | + | 14 26 1 0 0 0 0 |
| − | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | 27 29 1 0 0 0 0 | + | 27 29 1 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 |
| − | 29 32 1 0 0 0 0 | + | 29 32 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FAANP0019 | + | ID FL2FAANP0019 |
| − | KNApSAcK_ID C00014258 | + | KNApSAcK_ID C00014258 |
| − | NAME 2'',3''-Dihydroxylupinifolin;5,4'-Dihydroxy-8-(2,3-dihydroxy-3-methylbutyl)-6'',6''-dimethylpyrano[2'',3'':7,6]flavanone | + | NAME 2'',3''-Dihydroxylupinifolin;5,4'-Dihydroxy-8-(2,3-dihydroxy-3-methylbutyl)-6'',6''-dimethylpyrano[2'',3'':7,6]flavanone |
| − | CAS_RN 466689-46-3 | + | CAS_RN 466689-46-3 |
| − | FORMULA C25H28O7 | + | FORMULA C25H28O7 |
| − | EXACTMASS 440.18350325 | + | EXACTMASS 440.18350325 |
| − | AVERAGEMASS 440.48562000000004 | + | AVERAGEMASS 440.48562000000004 |
| − | SMILES O(C1(C)C)c(c(CC(O)C(C)(C)O)2)c(c(c(C(=O)3)c2OC(c(c4)ccc(c4)O)C3)O)C=C1 | + | SMILES O(C1(C)C)c(c(CC(O)C(C)(C)O)2)c(c(c(C(=O)3)c2OC(c(c4)ccc(c4)O)C3)O)C=C1 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
32 35 0 0 0 0 0 0 0 0999 V2000
-0.3422 -1.3985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3280 -0.5736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4128 -1.8240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0866 -1.4231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0773 -0.5567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3935 -0.1735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7918 -0.1442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4128 -2.5657 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5063 -0.5567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2208 -0.1442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2208 0.6808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5063 1.0933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7918 0.6808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0353 -0.1489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7567 -0.5491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7567 -1.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0353 -1.7987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0353 -2.5827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8460 1.0418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4711 -0.1366 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1855 -0.5491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1855 -1.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4711 -1.7864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7638 -0.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8460 -0.9304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0353 0.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7497 0.9825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4642 0.5700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7497 1.8075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0353 2.2200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5622 1.6642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0319 2.5827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
1 3 1 0 0 0 0
3 4 1 0 0 0 0
4 5 1 0 0 0 0
5 6 1 0 0 0 0
6 2 1 0 0 0 0
5 7 1 6 0 0 0
3 8 2 0 0 0 0
7 9 2 0 0 0 0
9 10 1 0 0 0 0
10 11 2 0 0 0 0
11 12 1 0 0 0 0
12 13 2 0 0 0 0
13 7 1 0 0 0 0
2 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 1 1 0 0 0 0
17 18 1 0 0 0 0
11 19 1 0 0 0 0
15 20 1 0 0 0 0
20 21 1 0 0 0 0
21 22 1 0 0 0 0
22 23 2 0 0 0 0
23 16 1 0 0 0 0
21 24 1 0 0 0 0
21 25 1 0 0 0 0
14 26 1 0 0 0 0
26 27 1 0 0 0 0
27 28 1 0 0 0 0
27 29 1 0 0 0 0
29 30 1 0 0 0 0
29 31 1 0 0 0 0
29 32 1 0 0 0 0
S SKP 8
ID FL2FAANP0019
KNApSAcK_ID C00014258
NAME 2'',3''-Dihydroxylupinifolin;5,4'-Dihydroxy-8-(2,3-dihydroxy-3-methylbutyl)-6'',6''-dimethylpyrano[2'',3'':7,6]flavanone
CAS_RN 466689-46-3
FORMULA C25H28O7
EXACTMASS 440.18350325
AVERAGEMASS 440.48562000000004
SMILES O(C1(C)C)c(c(CC(O)C(C)(C)O)2)c(c(c(C(=O)3)c2OC(c(c4)ccc(c4)O)C3)O)C=C1
M END
