Mol:FL2FACNP0009
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 34 0 0 0 0 0 0 0 0999 V2000 | + | 31 34 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.8235 -0.3966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8235 -0.3966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8050 -1.2004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8050 -1.2004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0278 -1.5856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0278 -1.5856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3730 -1.1845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3730 -1.1845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3588 -0.3596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3588 -0.3596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0845 0.0654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0845 0.0654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3820 -1.6100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3820 -1.6100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0558 -1.2091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0558 -1.2091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0465 -0.3427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0465 -0.3427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3627 0.0405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3627 0.0405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7610 0.0698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7610 0.0698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4521 -0.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4521 -0.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1595 0.0751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1595 0.0751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1884 0.8986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1884 0.8986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4722 1.3364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4722 1.3364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7518 0.9362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7518 0.9362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3820 -2.3517 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3820 -2.3517 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0278 -2.4340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0278 -2.4340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7607 1.2290 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7607 1.2290 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7643 -0.2741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7643 -0.2741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5289 -0.0107 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5289 -0.0107 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2158 -0.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2158 -0.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1972 -1.2326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1972 -1.2326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4918 -1.6184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4918 -1.6184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.7445 -0.1235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.7445 -0.1235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.7643 -0.7454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.7643 -0.7454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0845 0.7840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0845 0.7840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7989 1.1965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7989 1.1965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7989 2.0215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7989 2.0215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0845 2.4340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0845 2.4340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5134 2.4340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5134 2.4340 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 |
| − | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
| − | 14 19 1 0 0 0 0 | + | 14 19 1 0 0 0 0 |
| − | 13 20 1 0 0 0 0 | + | 13 20 1 0 0 0 0 |
| − | 1 21 1 0 0 0 0 | + | 1 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 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 2 1 0 0 0 0 | + | 24 2 1 0 0 0 0 |
| − | 22 25 1 0 0 0 0 | + | 22 25 1 0 0 0 0 |
| − | 22 26 1 0 0 0 0 | + | 22 26 1 0 0 0 0 |
| − | 6 27 1 0 0 0 0 | + | 6 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 FL2FACNP0009 | + | ID FL2FACNP0009 |
| − | KNApSAcK_ID C00014252 | + | KNApSAcK_ID C00014252 |
| − | NAME Dorsmanin J;5,3',4'-Trihydroxy-8-prenyl-6'',6''-dimethyldihydropyrano[2'',3'':7,6]flavanone | + | NAME Dorsmanin J;5,3',4'-Trihydroxy-8-prenyl-6'',6''-dimethyldihydropyrano[2'',3'':7,6]flavanone |
| − | CAS_RN 329703-76-6 | + | CAS_RN 329703-76-6 |
| − | FORMULA C25H28O6 | + | FORMULA C25H28O6 |
| − | EXACTMASS 424.188588628 | + | EXACTMASS 424.188588628 |
| − | AVERAGEMASS 424.48622 | + | AVERAGEMASS 424.48622 |
| − | SMILES c(c4)(O)c(O)cc(c4)C(O3)CC(c(c32)c(O)c(c1c2CC=C(C)C)CCC(O1)(C)C)=O | + | SMILES c(c4)(O)c(O)cc(c4)C(O3)CC(c(c32)c(O)c(c1c2CC=C(C)C)CCC(O1)(C)C)=O |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
31 34 0 0 0 0 0 0 0 0999 V2000
-1.8235 -0.3966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8050 -1.2004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0278 -1.5856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3730 -1.1845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3588 -0.3596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0845 0.0654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3820 -1.6100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0558 -1.2091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0465 -0.3427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3627 0.0405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7610 0.0698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4521 -0.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1595 0.0751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1884 0.8986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4722 1.3364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7518 0.9362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3820 -2.3517 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0278 -2.4340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7607 1.2290 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7643 -0.2741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5289 -0.0107 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2158 -0.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1972 -1.2326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4918 -1.6184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7445 -0.1235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7643 -0.7454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0845 0.7840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7989 1.1965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7989 2.0215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0845 2.4340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5134 2.4340 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
3 18 1 0 0 0 0
14 19 1 0 0 0 0
13 20 1 0 0 0 0
1 21 1 0 0 0 0
21 22 1 0 0 0 0
22 23 1 0 0 0 0
23 24 1 0 0 0 0
24 2 1 0 0 0 0
22 25 1 0 0 0 0
22 26 1 0 0 0 0
6 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 FL2FACNP0009
KNApSAcK_ID C00014252
NAME Dorsmanin J;5,3',4'-Trihydroxy-8-prenyl-6'',6''-dimethyldihydropyrano[2'',3'':7,6]flavanone
CAS_RN 329703-76-6
FORMULA C25H28O6
EXACTMASS 424.188588628
AVERAGEMASS 424.48622
SMILES c(c4)(O)c(O)cc(c4)C(O3)CC(c(c32)c(O)c(c1c2CC=C(C)C)CCC(O1)(C)C)=O
M END
