Mol:FL3F29ND0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 26 30 0 0 0 0 0 0 0 0999 V2000 | + | 26 30 0 0 0 0 0 0 0 0999 V2000 |
| − | -0.3082 -0.2311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3082 -0.2311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3082 0.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3082 0.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0227 1.0064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0227 1.0064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0227 -0.6436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0227 -0.6436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4062 -0.6436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4062 -0.6436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1207 -0.2311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1207 -0.2311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1207 0.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1207 0.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4062 1.0064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4062 1.0064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8352 1.0064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8352 1.0064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5496 0.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5496 0.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2641 1.0064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2641 1.0064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2641 1.8314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2641 1.8314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5496 2.2439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5496 2.2439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8352 1.8314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8352 1.8314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4062 -1.4686 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4062 -1.4686 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7372 -0.2311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7372 -0.2311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7372 0.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7372 0.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1942 1.8133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1942 1.8133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0147 1.8996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0147 1.8996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3503 1.1459 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3503 1.1459 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4516 -0.6436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4516 -0.6436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4516 -1.4686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4516 -1.4686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7372 -1.8811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7372 -1.8811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0227 -1.4686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0227 -1.4686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2641 -1.3254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2641 -1.3254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7338 -2.2439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7338 -2.2439 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 17 2 0 0 0 0 | + | 3 17 2 0 0 0 0 |
| − | 16 4 2 0 0 0 0 | + | 16 4 2 0 0 0 0 |
| − | 4 1 1 0 0 0 0 | + | 4 1 1 0 0 0 0 |
| − | 1 5 1 0 0 0 0 | + | 1 5 1 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 6 7 2 0 0 0 0 | + | 6 7 2 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 8 2 1 0 0 0 0 | + | 8 2 1 0 0 0 0 |
| − | 7 9 1 0 0 0 0 | + | 7 9 1 0 0 0 0 |
| − | 9 10 2 0 0 0 0 | + | 9 10 2 0 0 0 0 |
| − | 10 11 1 0 0 0 0 | + | 10 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 9 1 0 0 0 0 | + | 14 9 1 0 0 0 0 |
| − | 5 15 2 0 0 0 0 | + | 5 15 2 0 0 0 0 |
| − | 17 16 1 0 0 0 0 | + | 17 16 1 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 17 1 0 0 0 0 | + | 20 17 1 0 0 0 0 |
| − | 16 21 1 0 0 0 0 | + | 16 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 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 4 1 0 0 0 0 | + | 24 4 1 0 0 0 0 |
| − | 22 25 1 0 0 0 0 | + | 22 25 1 0 0 0 0 |
| − | 22 26 1 0 0 0 0 | + | 22 26 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3F29ND0001 | + | ID FL3F29ND0001 |
| − | KNApSAcK_ID C00013455 | + | KNApSAcK_ID C00013455 |
| − | NAME Sanaganone;10,10-Dimethyl-5-phenyl-furo[2',3':5,6]benzo[1,2-b:4,3-b']dipyran-7(10H)-one | + | NAME Sanaganone;10,10-Dimethyl-5-phenyl-furo[2',3':5,6]benzo[1,2-b:4,3-b']dipyran-7(10H)-one |
| − | CAS_RN 169790-22-1 | + | CAS_RN 169790-22-1 |
| − | FORMULA C22H16O4 | + | FORMULA C22H16O4 |
| − | EXACTMASS 344.104859 | + | EXACTMASS 344.104859 |
| − | AVERAGEMASS 344.36004 | + | AVERAGEMASS 344.36004 |
| − | SMILES CC(C)(O1)C=Cc(c43)c1c(c(c(OC(c(c5)cccc5)=CC(=O)4)3)2)occ2 | + | SMILES CC(C)(O1)C=Cc(c43)c1c(c(c(OC(c(c5)cccc5)=CC(=O)4)3)2)occ2 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
26 30 0 0 0 0 0 0 0 0999 V2000
-0.3082 -0.2311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3082 0.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0227 1.0064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0227 -0.6436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4062 -0.6436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1207 -0.2311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1207 0.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4062 1.0064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8352 1.0064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5496 0.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2641 1.0064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2641 1.8314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5496 2.2439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8352 1.8314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4062 -1.4686 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7372 -0.2311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7372 0.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1942 1.8133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0147 1.8996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3503 1.1459 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4516 -0.6436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4516 -1.4686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7372 -1.8811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0227 -1.4686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2641 -1.3254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7338 -2.2439 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 17 2 0 0 0 0
16 4 2 0 0 0 0
4 1 1 0 0 0 0
1 5 1 0 0 0 0
5 6 1 0 0 0 0
6 7 2 0 0 0 0
7 8 1 0 0 0 0
8 2 1 0 0 0 0
7 9 1 0 0 0 0
9 10 2 0 0 0 0
10 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 9 1 0 0 0 0
5 15 2 0 0 0 0
17 16 1 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 17 1 0 0 0 0
16 21 1 0 0 0 0
21 22 1 0 0 0 0
22 23 1 0 0 0 0
23 24 2 0 0 0 0
24 4 1 0 0 0 0
22 25 1 0 0 0 0
22 26 1 0 0 0 0
S SKP 8
ID FL3F29ND0001
KNApSAcK_ID C00013455
NAME Sanaganone;10,10-Dimethyl-5-phenyl-furo[2',3':5,6]benzo[1,2-b:4,3-b']dipyran-7(10H)-one
CAS_RN 169790-22-1
FORMULA C22H16O4
EXACTMASS 344.104859
AVERAGEMASS 344.36004
SMILES CC(C)(O1)C=Cc(c43)c1c(c(c(OC(c(c5)cccc5)=CC(=O)4)3)2)occ2
M END
