Mol:FL2FAAGI0002
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 36 39 0 0 0 0 0 0 0 0999 V2000 | + | 36 39 0 0 0 0 0 0 0 0999 V2000 |
| − | -0.8554 -0.3609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8554 -0.3609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1428 0.0547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1428 0.0547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8522 -1.1859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8522 -1.1859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1355 -1.5952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1355 -1.5952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5772 -1.1796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5772 -1.1796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5735 -0.3546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5735 -0.3546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2934 -1.5889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2934 -1.5889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0061 -1.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0061 -1.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0024 -0.3483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0024 -0.3483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2861 0.0611 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2861 0.0611 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6562 0.0326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6562 0.0326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3723 -0.3772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3723 -0.3772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.0851 0.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.0851 0.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.0819 0.8631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.0819 0.8631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3659 1.2728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3659 1.2728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6530 0.8576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6530 0.8576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2945 -2.2322 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2945 -2.2322 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1355 -2.3034 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1355 -2.3034 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.6689 1.2019 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.6689 1.2019 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1428 0.7849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1428 0.7849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7666 1.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7666 1.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7666 1.9233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7666 1.9233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1467 2.2812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1467 2.2812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4249 2.3034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4249 2.3034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4732 -0.0042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4732 -0.0042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.1857 0.1356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.1857 0.1356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.7730 -0.5790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.7730 -0.5790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9747 -0.3699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9747 -0.3699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1812 -0.5968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1812 -0.5968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5938 0.1180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5938 0.1180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3922 -0.0911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3922 -0.0911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | -4.2217 -0.3200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.2217 -0.3200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1462 -1.0098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1462 -1.0098 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 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 |
| − | 6 2 1 0 0 0 0 | + | 6 2 1 0 0 0 0 |
| − | 5 7 1 0 0 0 0 | + | 5 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 6 1 0 0 0 0 | + | 10 6 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 |
| − | 4 18 1 0 0 0 0 | + | 4 18 1 0 0 0 0 |
| − | 14 19 1 0 0 0 0 | + | 14 19 1 0 0 0 0 |
| − | 2 20 1 0 0 0 0 | + | 2 20 1 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 21 22 2 0 0 0 0 | + | 21 22 2 0 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | 22 24 1 0 0 0 0 | + | 22 24 1 0 0 0 0 |
| − | 1 25 1 0 0 0 0 | + | 1 25 1 0 0 0 0 |
| − | 26 27 1 1 0 0 0 | + | 26 27 1 1 0 0 0 |
| − | 27 28 1 1 0 0 0 | + | 27 28 1 1 0 0 0 |
| − | 29 28 1 1 0 0 0 | + | 29 28 1 1 0 0 0 |
| − | 29 30 1 0 0 0 0 | + | 29 30 1 0 0 0 0 |
| − | 30 31 1 0 0 0 0 | + | 30 31 1 0 0 0 0 |
| − | 31 26 1 0 0 0 0 | + | 31 26 1 0 0 0 0 |
| − | 31 32 1 0 0 0 0 | + | 31 32 1 0 0 0 0 |
| − | 32 33 1 0 0 0 0 | + | 32 33 1 0 0 0 0 |
| − | 26 34 1 0 0 0 0 | + | 26 34 1 0 0 0 0 |
| − | 27 35 1 0 0 0 0 | + | 27 35 1 0 0 0 0 |
| − | 28 36 1 0 0 0 0 | + | 28 36 1 0 0 0 0 |
| − | 29 25 1 0 0 0 0 | + | 29 25 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FAAGI0002 | + | ID FL2FAAGI0002 |
| − | KNApSAcK_ID C00014360 | + | KNApSAcK_ID C00014360 |
| − | NAME Phellodensin F;Flavaprin;5,7,4'-Trihydroxy-8-C-prenylflavanone 7-glucoside | + | NAME Phellodensin F;Flavaprin;5,7,4'-Trihydroxy-8-C-prenylflavanone 7-glucoside |
| − | CAS_RN 53846-49-4 | + | CAS_RN 53846-49-4 |
| − | FORMULA C26H30O10 | + | FORMULA C26H30O10 |
| − | EXACTMASS 502.18389718 | + | EXACTMASS 502.18389718 |
| − | AVERAGEMASS 502.5104 | + | AVERAGEMASS 502.5104 |
| − | SMILES c(c42)(cc(c(CC=C(C)C)c2OC(CC4=O)c(c3)ccc(O)c3)OC(O1)C(C(C(O)C(CO)1)O)O)O | + | SMILES c(c42)(cc(c(CC=C(C)C)c2OC(CC4=O)c(c3)ccc(O)c3)OC(O1)C(C(C(O)C(CO)1)O)O)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/
36 39 0 0 0 0 0 0 0 0999 V2000
-0.8554 -0.3609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1428 0.0547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8522 -1.1859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1355 -1.5952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5772 -1.1796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5735 -0.3546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2934 -1.5889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0061 -1.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0024 -0.3483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2861 0.0611 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6562 0.0326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3723 -0.3772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0851 0.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0819 0.8631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3659 1.2728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6530 0.8576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2945 -2.2322 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1355 -2.3034 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6689 1.2019 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1428 0.7849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7666 1.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7666 1.9233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1467 2.2812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4249 2.3034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4732 -0.0042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.1857 0.1356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7730 -0.5790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9747 -0.3699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1812 -0.5968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5938 0.1180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.3922 -0.0911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5491 0.4948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0290 0.7718 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.6689 -0.3476 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.2217 -0.3200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1462 -1.0098 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 2 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
6 2 1 0 0 0 0
5 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 6 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
4 18 1 0 0 0 0
14 19 1 0 0 0 0
2 20 1 0 0 0 0
20 21 1 0 0 0 0
21 22 2 0 0 0 0
22 23 1 0 0 0 0
22 24 1 0 0 0 0
1 25 1 0 0 0 0
26 27 1 1 0 0 0
27 28 1 1 0 0 0
29 28 1 1 0 0 0
29 30 1 0 0 0 0
30 31 1 0 0 0 0
31 26 1 0 0 0 0
31 32 1 0 0 0 0
32 33 1 0 0 0 0
26 34 1 0 0 0 0
27 35 1 0 0 0 0
28 36 1 0 0 0 0
29 25 1 0 0 0 0
S SKP 8
ID FL2FAAGI0002
KNApSAcK_ID C00014360
NAME Phellodensin F;Flavaprin;5,7,4'-Trihydroxy-8-C-prenylflavanone 7-glucoside
CAS_RN 53846-49-4
FORMULA C26H30O10
EXACTMASS 502.18389718
AVERAGEMASS 502.5104
SMILES c(c42)(cc(c(CC=C(C)C)c2OC(CC4=O)c(c3)ccc(O)c3)OC(O1)C(C(C(O)C(CO)1)O)O)O
M END
