Mol:FL2FACNI0017
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 34 0 0 0 0 0 0 0 0999 V2000 | + | 32 34 0 0 0 0 0 0 0 0999 V2000 |
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| − | 0.0606 -1.2391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0606 -1.2391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | 2.1945 0.0152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1945 0.0152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8856 -0.3713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8856 -0.3713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5970 0.0272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5970 0.0272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6175 0.8520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6175 0.8520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9057 1.2818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9057 1.2818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1853 0.8816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1853 0.8816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8155 -2.4063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8155 -2.4063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1045 -0.0387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1045 -0.0387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5943 -2.4903 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5943 -2.4903 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.2405 1.2117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.2405 1.2117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | 5 6 2 0 0 0 0 | + | 5 6 2 0 0 0 0 |
| − | 6 1 1 0 0 0 0 | + | 6 1 1 0 0 0 0 |
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| − | 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 |
| − | 1 18 1 0 0 0 0 | + | 1 18 1 0 0 0 0 |
| − | 3 19 1 0 0 0 0 | + | 3 19 1 0 0 0 0 |
| − | 14 20 1 0 0 0 0 | + | 14 20 1 0 0 0 0 |
| − | 13 21 1 0 0 0 0 | + | 13 21 1 0 0 0 0 |
| − | 2 22 1 0 0 0 0 | + | 2 22 1 0 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | 23 24 2 0 0 0 0 | + | 23 24 2 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 24 26 1 0 0 0 0 | + | 24 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 1 0 0 0 0 | + | 28 29 1 0 0 0 0 |
| − | 28 30 1 0 0 0 0 | + | 28 30 1 0 0 0 0 |
| − | 30 31 2 0 0 0 0 | + | 30 31 2 0 0 0 0 |
| − | 30 32 1 0 0 0 0 | + | 30 32 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FACNI0017 | + | ID FL2FACNI0017 |
| − | KNApSAcK_ID C00014202 | + | KNApSAcK_ID C00014202 |
| − | NAME Dorsmanin H;5,7,3',4'-Tetrahydroxy-6-prenyl-8-(2-hydroxy-3-methylbut-3-enyl)flavanone | + | NAME Dorsmanin H;5,7,3',4'-Tetrahydroxy-6-prenyl-8-(2-hydroxy-3-methylbut-3-enyl)flavanone |
| − | CAS_RN 234766-44-0 | + | CAS_RN 234766-44-0 |
| − | FORMULA C25H28O7 | + | FORMULA C25H28O7 |
| − | EXACTMASS 440.18350325 | + | EXACTMASS 440.18350325 |
| − | AVERAGEMASS 440.48562000000004 | + | AVERAGEMASS 440.48562000000004 |
| − | SMILES C(C2)(=O)c(c(O)1)c(OC2c(c3)cc(c(c3)O)O)c(CC(O)C(C)=C)c(O)c1CC=C(C)C | + | SMILES C(C2)(=O)c(c(O)1)c(OC2c(c3)cc(c(c3)O)O)c(CC(O)C(C)=C)c(O)c1CC=C(C)C |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
32 34 0 0 0 0 0 0 0 0999 V2000
-1.3900 -0.4512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3714 -1.2550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5943 -1.6402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0606 -1.2391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0747 -0.4142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6509 0.0108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8155 -1.6646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4893 -1.2637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4801 -0.3973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7962 -0.0141 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1945 0.0152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8856 -0.3713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5970 0.0272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6175 0.8520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9057 1.2818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1853 0.8816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8155 -2.4063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1045 -0.0387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5943 -2.4903 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2405 1.2117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2628 -0.3572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1194 -1.6868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8338 -1.2743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5483 -1.6868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5483 -2.5118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2628 -1.2743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6509 0.8618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3654 1.2743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0799 0.8618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3654 2.0993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6509 2.5118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0799 2.5118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
2 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 1 1 0 0 0 0
4 7 1 0 0 0 0
7 8 1 0 0 0 0
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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
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16 11 1 0 0 0 0
7 17 2 0 0 0 0
1 18 1 0 0 0 0
3 19 1 0 0 0 0
14 20 1 0 0 0 0
13 21 1 0 0 0 0
2 22 1 0 0 0 0
22 23 1 0 0 0 0
23 24 2 0 0 0 0
24 25 1 0 0 0 0
24 26 1 0 0 0 0
6 27 1 0 0 0 0
27 28 1 0 0 0 0
28 29 1 0 0 0 0
28 30 1 0 0 0 0
30 31 2 0 0 0 0
30 32 1 0 0 0 0
S SKP 8
ID FL2FACNI0017
KNApSAcK_ID C00014202
NAME Dorsmanin H;5,7,3',4'-Tetrahydroxy-6-prenyl-8-(2-hydroxy-3-methylbut-3-enyl)flavanone
CAS_RN 234766-44-0
FORMULA C25H28O7
EXACTMASS 440.18350325
AVERAGEMASS 440.48562000000004
SMILES C(C2)(=O)c(c(O)1)c(OC2c(c3)cc(c(c3)O)O)c(CC(O)C(C)=C)c(O)c1CC=C(C)C
M END
