Mol:FL2F2CNI0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 28 31 0 0 0 0 0 0 0 0999 V2000 | + | 28 31 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.7130 0.3825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7130 0.3825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6946 -0.4339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6946 -0.4339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9745 -0.8348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9745 -0.8348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2724 -0.4222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2724 -0.4222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2725 0.4028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2725 0.4028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9925 0.8152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9925 0.8152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4600 -0.8346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4600 -0.8346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1566 -0.4220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1566 -0.4220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1475 0.4184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1475 0.4184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4419 0.8154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4419 0.8154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8620 0.8309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8620 0.8309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5689 0.4336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5689 0.4336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2820 0.8465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2820 0.8465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2820 1.6723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2820 1.6723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5672 2.0839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5672 2.0839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8530 1.6713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8530 1.6713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4600 -1.6595 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4600 -1.6595 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4274 0.7950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4274 0.7950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1235 -0.4339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1235 -0.4339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.8380 -0.8464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8380 -0.8464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.8380 -1.6714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8380 -1.6714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1235 -2.0839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1235 -2.0839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.5524 -2.0839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.5524 -2.0839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.0675 0.5919 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.0675 0.5919 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5524 1.2602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5524 1.2602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.0675 1.9279 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.0675 1.9279 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1461 0.3801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1461 0.3801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4090 -0.8464 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4090 -0.8464 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 |
| − | 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 |
| − | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
| − | 20 21 2 0 0 0 0 | + | 20 21 2 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 21 23 1 0 0 0 0 | + | 21 23 1 0 0 0 0 |
| − | 13 24 1 0 0 0 0 | + | 13 24 1 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 26 14 1 0 0 0 0 | + | 26 14 1 0 0 0 0 |
| − | 18 27 1 0 0 0 0 | + | 18 27 1 0 0 0 0 |
| − | 2 28 1 0 0 0 0 | + | 2 28 1 0 0 0 0 |
| − | 28 19 1 0 0 0 0 | + | 28 19 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2F2CNI0001 | + | ID FL2F2CNI0001 |
| − | KNApSAcK_ID C00014167 | + | KNApSAcK_ID C00014167 |
| − | NAME Ponganone V;7-Methoxy-6-O-prenyl-3',4'-methylenedioxyflavanone | + | NAME Ponganone V;7-Methoxy-6-O-prenyl-3',4'-methylenedioxyflavanone |
| − | CAS_RN 142608-91-1 | + | CAS_RN 142608-91-1 |
| − | FORMULA C22H22O6 | + | FORMULA C22H22O6 |
| − | EXACTMASS 382.141638436 | + | EXACTMASS 382.141638436 |
| − | AVERAGEMASS 382.40648000000004 | + | AVERAGEMASS 382.40648000000004 |
| − | SMILES c(O4)(c3OC4)cc(cc3)C(O1)CC(=O)c(c2)c1cc(c2OCC=C(C)C)OC | + | SMILES c(O4)(c3OC4)cc(cc3)C(O1)CC(=O)c(c2)c1cc(c2OCC=C(C)C)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/
28 31 0 0 0 0 0 0 0 0999 V2000
-1.7130 0.3825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6946 -0.4339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9745 -0.8348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2724 -0.4222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2725 0.4028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9925 0.8152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4600 -0.8346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1566 -0.4220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1475 0.4184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4419 0.8154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8620 0.8309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5689 0.4336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2820 0.8465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2820 1.6723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5672 2.0839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8530 1.6713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4600 -1.6595 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4274 0.7950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1235 -0.4339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8380 -0.8464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8380 -1.6714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1235 -2.0839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5524 -2.0839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0675 0.5919 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5524 1.2602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0675 1.9279 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1461 0.3801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4090 -0.8464 0.0000 O 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
19 20 1 0 0 0 0
20 21 2 0 0 0 0
21 22 1 0 0 0 0
21 23 1 0 0 0 0
13 24 1 0 0 0 0
24 25 1 0 0 0 0
25 26 1 0 0 0 0
26 14 1 0 0 0 0
18 27 1 0 0 0 0
2 28 1 0 0 0 0
28 19 1 0 0 0 0
S SKP 8
ID FL2F2CNI0001
KNApSAcK_ID C00014167
NAME Ponganone V;7-Methoxy-6-O-prenyl-3',4'-methylenedioxyflavanone
CAS_RN 142608-91-1
FORMULA C22H22O6
EXACTMASS 382.141638436
AVERAGEMASS 382.40648000000004
SMILES c(O4)(c3OC4)cc(cc3)C(O1)CC(=O)c(c2)c1cc(c2OCC=C(C)C)OC
M END
