Mol:FL2FA9NP0004
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 |
| − | -1.1912 0.1145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1912 0.1145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1726 -0.6893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1726 -0.6893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3955 -1.0745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3955 -1.0745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2594 -0.6734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2594 -0.6734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2736 0.1514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2736 0.1514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4521 0.5765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4521 0.5765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0143 -1.0989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0143 -1.0989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6881 -0.6980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6881 -0.6980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6789 0.1684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6789 0.1684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9950 0.5516 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9950 0.5516 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3934 0.5809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3934 0.5809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0845 0.1944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0845 0.1944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7958 0.5929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7958 0.5929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8163 1.4177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8163 1.4177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1045 1.8474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1045 1.8474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3842 1.4473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3842 1.4473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0143 -1.8407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0143 -1.8407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4733 1.4105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4733 1.4105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2523 1.8566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2523 1.8566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9913 1.3946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9913 1.3946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9748 0.4865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9748 0.4865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6015 1.7469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6015 1.7469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5945 1.0464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5945 1.0464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8892 -1.1030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8892 -1.1030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5687 -0.7107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5687 -0.7107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2561 -1.1076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2561 -1.1076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2561 -1.8566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2561 -1.8566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.8163 -0.7842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8163 -0.7842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3955 -1.8405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3955 -1.8405 0.0000 O 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 |
| − | 6 18 1 0 0 0 0 | + | 6 18 1 0 0 0 0 |
| − | 18 19 2 0 0 0 0 | + | 18 19 2 0 0 0 0 |
| − | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 21 1 1 0 0 0 0 | + | 21 1 1 0 0 0 0 |
| − | 20 22 1 0 0 0 0 | + | 20 22 1 0 0 0 0 |
| − | 20 23 1 0 0 0 0 | + | 20 23 1 0 0 0 0 |
| − | 2 24 1 0 0 0 0 | + | 2 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 2 0 0 0 0 | + | 26 27 2 0 0 0 0 |
| − | 26 28 1 0 0 0 0 | + | 26 28 1 0 0 0 0 |
| − | 3 29 1 0 0 0 0 | + | 3 29 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FA9NP0004 | + | ID FL2FA9NP0004 |
| − | KNApSAcK_ID C00014225 | + | KNApSAcK_ID C00014225 |
| − | NAME Spinoflavanone A;5-Hydroxy-6-(3-methyl-1,3-butadienyl)-6'',6''-dimethylpyrano[2'',3'':7,8]flavanone | + | NAME Spinoflavanone A;5-Hydroxy-6-(3-methyl-1,3-butadienyl)-6'',6''-dimethylpyrano[2'',3'':7,8]flavanone |
| − | CAS_RN 146959-80-0 | + | CAS_RN 146959-80-0 |
| − | FORMULA C25H24O4 | + | FORMULA C25H24O4 |
| − | EXACTMASS 388.167459256 | + | EXACTMASS 388.167459256 |
| − | AVERAGEMASS 388.45565999999997 | + | AVERAGEMASS 388.45565999999997 |
| − | SMILES C(O1)(C)(C)C=Cc(c42)c(c(C=CC(C)=C)c(O)c2C(CC(O4)c(c3)cccc3)=O)1 | + | SMILES C(O1)(C)(C)C=Cc(c42)c(c(C=CC(C)=C)c(O)c2C(CC(O4)c(c3)cccc3)=O)1 |
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
-1.1912 0.1145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1726 -0.6893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3955 -1.0745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2594 -0.6734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2736 0.1514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4521 0.5765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0143 -1.0989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6881 -0.6980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6789 0.1684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9950 0.5516 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3934 0.5809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0845 0.1944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7958 0.5929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8163 1.4177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1045 1.8474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3842 1.4473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0143 -1.8407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4733 1.4105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2523 1.8566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9913 1.3946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9748 0.4865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6015 1.7469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5945 1.0464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8892 -1.1030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5687 -0.7107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2561 -1.1076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2561 -1.8566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8163 -0.7842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3955 -1.8405 0.0000 O 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
6 18 1 0 0 0 0
18 19 2 0 0 0 0
19 20 1 0 0 0 0
20 21 1 0 0 0 0
21 1 1 0 0 0 0
20 22 1 0 0 0 0
20 23 1 0 0 0 0
2 24 1 0 0 0 0
24 25 2 0 0 0 0
25 26 1 0 0 0 0
26 27 2 0 0 0 0
26 28 1 0 0 0 0
3 29 1 0 0 0 0
S SKP 8
ID FL2FA9NP0004
KNApSAcK_ID C00014225
NAME Spinoflavanone A;5-Hydroxy-6-(3-methyl-1,3-butadienyl)-6'',6''-dimethylpyrano[2'',3'':7,8]flavanone
CAS_RN 146959-80-0
FORMULA C25H24O4
EXACTMASS 388.167459256
AVERAGEMASS 388.45565999999997
SMILES C(O1)(C)(C)C=Cc(c42)c(c(C=CC(C)=C)c(O)c2C(CC(O4)c(c3)cccc3)=O)1
M END
