Mol:FL3F19NP0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 23 26 0 0 0 0 0 0 0 0999 V2000 | + | 23 26 0 0 0 0 0 0 0 0999 V2000 |
| − | -0.3578 -0.8243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3578 -0.8243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3578 0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3578 0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0723 0.4132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0723 0.4132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7868 0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7868 0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7868 -0.8243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7868 -0.8243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0723 -1.2368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0723 -1.2368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3566 -1.2368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3566 -1.2368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0711 -0.8243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0711 -0.8243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0711 0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0711 0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3566 0.4132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3566 0.4132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7856 0.4132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7856 0.4132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5001 0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5001 0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2145 0.4132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2145 0.4132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2145 1.2382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2145 1.2382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5001 1.6507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5001 1.6507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7856 1.2382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7856 1.2382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3566 -2.0618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3566 -2.0618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0723 1.2382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0723 1.2382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7868 1.6507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7868 1.6507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5012 1.2382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5012 1.2382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5012 0.4132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5012 0.4132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2145 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2145 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5012 2.0618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5012 2.0618 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 |
| − | 1 7 1 0 0 0 0 | + | 1 7 1 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 8 9 2 0 0 0 0 | + | 8 9 2 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 10 2 1 0 0 0 0 | + | 10 2 1 0 0 0 0 |
| − | 9 11 1 0 0 0 0 | + | 9 11 1 0 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 |
| − | 3 18 1 0 0 0 0 | + | 3 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 4 1 0 0 0 0 | + | 21 4 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 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3F19NP0001 | + | ID FL3F19NP0001 |
| − | KNApSAcK_ID C00013434 | + | KNApSAcK_ID C00013434 |
| − | NAME 8,8-Dimethyl-2-phenyl-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one | + | NAME 8,8-Dimethyl-2-phenyl-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one |
| − | CAS_RN 64125-32-2 | + | CAS_RN 64125-32-2 |
| − | FORMULA C20H16O3 | + | FORMULA C20H16O3 |
| − | EXACTMASS 304.109944378 | + | EXACTMASS 304.109944378 |
| − | AVERAGEMASS 304.33924 | + | AVERAGEMASS 304.33924 |
| − | SMILES C(=C3)(c(c4)cccc4)Oc(c2C(=O)3)c(c(cc2)1)C=CC(C)(C)O1 | + | SMILES C(=C3)(c(c4)cccc4)Oc(c2C(=O)3)c(c(cc2)1)C=CC(C)(C)O1 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
23 26 0 0 0 0 0 0 0 0999 V2000
-0.3578 -0.8243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3578 0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0723 0.4132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7868 0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7868 -0.8243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0723 -1.2368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3566 -1.2368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0711 -0.8243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0711 0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3566 0.4132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7856 0.4132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5001 0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2145 0.4132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2145 1.2382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5001 1.6507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7856 1.2382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3566 -2.0618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0723 1.2382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7868 1.6507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5012 1.2382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5012 0.4132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2145 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5012 2.0618 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
1 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 2 0 0 0 0
9 10 1 0 0 0 0
10 2 1 0 0 0 0
9 11 1 0 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
3 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 4 1 0 0 0 0
20 22 1 0 0 0 0
20 23 1 0 0 0 0
S SKP 8
ID FL3F19NP0001
KNApSAcK_ID C00013434
NAME 8,8-Dimethyl-2-phenyl-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one
CAS_RN 64125-32-2
FORMULA C20H16O3
EXACTMASS 304.109944378
AVERAGEMASS 304.33924
SMILES C(=C3)(c(c4)cccc4)Oc(c2C(=O)3)c(c(cc2)1)C=CC(C)(C)O1
M END
