Mol:FL2FAANI0021
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 30 32 0 0 0 0 0 0 0 0999 V2000 | + | 30 32 0 0 0 0 0 0 0 0999 V2000 |
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| − | -2.4860 -0.6444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4860 -0.6444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7089 -1.0296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7089 -1.0296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0540 -0.6285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0540 -0.6285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0399 0.1964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0399 0.1964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7655 0.6214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7655 0.6214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2991 -1.0540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2991 -1.0540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3747 -0.6531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3747 -0.6531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3655 0.2133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3655 0.2133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3184 0.5965 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3184 0.5965 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0799 0.6258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0799 0.6258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7710 0.2393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7710 0.2393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4824 0.6378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4824 0.6378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5029 1.4626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5029 1.4626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7911 1.8924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7911 1.8924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0707 1.4922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0707 1.4922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2991 -1.8790 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2991 -1.8790 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2191 0.5719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2191 0.5719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7089 -1.8542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7089 -1.8542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2005 -1.0569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2005 -1.0569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9058 -0.6497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9058 -0.6497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.6247 -1.0648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.6247 -1.0648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.6247 -1.8924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.6247 -1.8924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -5.3369 -0.6536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.3369 -0.6536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2173 1.8751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2173 1.8751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1969 0.2253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1969 0.2253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9069 0.6353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9069 0.6353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.6235 0.2215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.6235 0.2215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.6235 -0.6048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.6235 -0.6048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.3369 0.6334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.3369 0.6334 0.0000 C 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 |
| − | 2 3 1 0 0 0 0 | + | 2 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 1 1 0 0 0 0 | + | 6 1 1 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 |
| − | 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 |
| − | 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 |
| − | 14 25 1 0 0 0 0 | + | 14 25 1 0 0 0 0 |
| − | 13 26 1 0 0 0 0 | + | 13 26 1 0 0 0 0 |
| − | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
| − | 27 28 2 0 0 0 0 | + | 27 28 2 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 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FAANI0021 | + | ID FL2FAANI0021 |
| − | KNApSAcK_ID C00014173 | + | KNApSAcK_ID C00014173 |
| − | NAME Macarangaflavanone B;Paratocarpin L;5,7,4'-Trihydroxy-6,3'-diprenylflavanone | + | NAME Macarangaflavanone B;Paratocarpin L;5,7,4'-Trihydroxy-6,3'-diprenylflavanone |
| − | CAS_RN 97134-79-7 | + | CAS_RN 97134-79-7 |
| − | FORMULA C25H28O5 | + | FORMULA C25H28O5 |
| − | EXACTMASS 408.193674006 | + | EXACTMASS 408.193674006 |
| − | AVERAGEMASS 408.48682 | + | AVERAGEMASS 408.48682 |
| − | SMILES O=C(C2)c(c(OC2c(c3)cc(c(c3)O)CC=C(C)C)1)c(c(CC=C(C)C)c(O)c1)O | + | SMILES O=C(C2)c(c(OC2c(c3)cc(c(c3)O)CC=C(C)C)1)c(c(CC=C(C)C)c(O)c1)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/
30 32 0 0 0 0 0 0 0 0999 V2000
-2.5046 0.1594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4860 -0.6444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7089 -1.0296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0540 -0.6285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0399 0.1964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7655 0.6214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2991 -1.0540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3747 -0.6531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3655 0.2133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3184 0.5965 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0799 0.6258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7710 0.2393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4824 0.6378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5029 1.4626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7911 1.8924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0707 1.4922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2991 -1.8790 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2191 0.5719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7089 -1.8542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2005 -1.0569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9058 -0.6497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6247 -1.0648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6247 -1.8924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3369 -0.6536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2173 1.8751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1969 0.2253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9069 0.6353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6235 0.2215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6235 -0.6048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3369 0.6334 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
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
1 18 1 0 0 0 0
3 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
14 25 1 0 0 0 0
13 26 1 0 0 0 0
26 27 1 0 0 0 0
27 28 2 0 0 0 0
28 29 1 0 0 0 0
28 30 1 0 0 0 0
S SKP 8
ID FL2FAANI0021
KNApSAcK_ID C00014173
NAME Macarangaflavanone B;Paratocarpin L;5,7,4'-Trihydroxy-6,3'-diprenylflavanone
CAS_RN 97134-79-7
FORMULA C25H28O5
EXACTMASS 408.193674006
AVERAGEMASS 408.48682
SMILES O=C(C2)c(c(OC2c(c3)cc(c(c3)O)CC=C(C)C)1)c(c(CC=C(C)C)c(O)c1)O
M END
