Mol:FL2FBFNP0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 29 32 0 0 0 0 0 0 0 0999 V2000 | + | 29 32 0 0 0 0 0 0 0 0999 V2000 |
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| − | -2.4850 -0.4791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4850 -0.4791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | 0.3757 -0.4878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3757 -0.4878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | -0.3174 0.7618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3174 0.7618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0810 0.7911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0810 0.7911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7721 0.4046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7721 0.4046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4795 0.7964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4795 0.7964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5084 1.6199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5084 1.6199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7921 2.0577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7921 2.0577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0718 1.6575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0718 1.6575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2981 -1.6304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2981 -1.6304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2229 2.0324 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2229 2.0324 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7078 -1.6487 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7078 -1.6487 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8931 1.6455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8931 1.6455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1763 0.3941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1763 0.3941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | 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 |
| − | 18 20 1 0 0 0 0 | + | 18 20 1 0 0 0 0 |
| − | 13 21 1 0 0 0 0 | + | 13 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 19 23 1 0 0 0 0 | + | 19 23 1 0 0 0 0 |
| − | 6 24 1 0 0 0 0 | + | 6 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 |
| − | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
| − | 27 1 1 0 0 0 0 | + | 27 1 1 0 0 0 0 |
| − | 26 28 1 0 0 0 0 | + | 26 28 1 0 0 0 0 |
| − | 26 29 1 0 0 0 0 | + | 26 29 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FBFNP0001 | + | ID FL2FBFNP0001 |
| − | KNApSAcK_ID C00014243 | + | KNApSAcK_ID C00014243 |
| − | NAME Glyflavanone B;(2S)-5,3',4'-Trimethyoxy-6'',6''-dimethylpyrano[2'',3'':7,8]flavanone | + | NAME Glyflavanone B;(2S)-5,3',4'-Trimethyoxy-6'',6''-dimethylpyrano[2'',3'':7,8]flavanone |
| − | CAS_RN 167568-53-8 | + | CAS_RN 167568-53-8 |
| − | FORMULA C23H24O6 | + | FORMULA C23H24O6 |
| − | EXACTMASS 396.1572885 | + | EXACTMASS 396.1572885 |
| − | AVERAGEMASS 396.43306 | + | AVERAGEMASS 396.43306 |
| − | SMILES c(c1)(c(OC)cc(C(O2)CC(=O)c(c4OC)c2c(c(c4)3)C=CC(O3)(C)C)c1)OC | + | SMILES c(c1)(c(OC)cc(C(O2)CC(=O)c(c4OC)c2c(c(c4)3)C=CC(O3)(C)C)c1)OC |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
29 32 0 0 0 0 0 0 0 0999 V2000
-2.5036 0.3247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4850 -0.4791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7078 -0.8643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0530 -0.4632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0388 0.3617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7645 0.7867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2981 -0.8887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3757 -0.4878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3665 0.3786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3174 0.7618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0810 0.7911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7721 0.4046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4795 0.7964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5084 1.6199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7921 2.0577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0718 1.6575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2981 -1.6304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2229 2.0324 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7078 -1.6487 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8931 1.6455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1763 0.3941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8855 0.8035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4321 -2.0668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7950 1.6577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5647 2.0668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3037 1.6048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2872 0.7462 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.7654 2.0665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8931 1.2646 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
18 20 1 0 0 0 0
13 21 1 0 0 0 0
21 22 1 0 0 0 0
19 23 1 0 0 0 0
6 24 1 0 0 0 0
24 25 2 0 0 0 0
25 26 1 0 0 0 0
26 27 1 0 0 0 0
27 1 1 0 0 0 0
26 28 1 0 0 0 0
26 29 1 0 0 0 0
S SKP 8
ID FL2FBFNP0001
KNApSAcK_ID C00014243
NAME Glyflavanone B;(2S)-5,3',4'-Trimethyoxy-6'',6''-dimethylpyrano[2'',3'':7,8]flavanone
CAS_RN 167568-53-8
FORMULA C23H24O6
EXACTMASS 396.1572885
AVERAGEMASS 396.43306
SMILES c(c1)(c(OC)cc(C(O2)CC(=O)c(c4OC)c2c(c(c4)3)C=CC(O3)(C)C)c1)OC
M END
