Mol:FLIDWXNS0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 19 22 0 0 0 0 0 0 0 0999 V2000 | + | 19 22 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.5484 0.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5484 0.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5484 0.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5484 0.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0480 0.1071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0480 0.1071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5475 0.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5475 0.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5475 0.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5475 0.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0480 1.2628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0480 1.2628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0471 0.1071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0471 0.1071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4534 0.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4534 0.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4534 0.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4534 0.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0471 1.2628 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0471 1.2628 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0731 -0.4581 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0731 -0.4581 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6478 -0.5185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6478 -0.5185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8828 0.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8828 0.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9874 -0.9860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9874 -0.9860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5621 -0.9256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5621 -0.9256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7972 -0.3977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7972 -0.3977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4575 0.0698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4575 0.0698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9916 -1.3123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9916 -1.3123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9916 1.3123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9916 1.3123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 2 3 2 0 0 0 0 | + | 2 3 2 0 0 0 0 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 4 5 2 0 0 0 0 | + | 4 5 2 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 6 1 2 0 0 0 0 | + | 6 1 2 0 0 0 0 |
| − | 4 7 1 0 0 0 0 | + | 4 7 1 0 0 0 0 |
| − | 7 8 2 0 0 0 0 | + | 7 8 2 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 |
| − | 7 11 1 0 0 0 0 | + | 7 11 1 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 12 13 2 0 0 0 0 | + | 12 13 2 0 0 0 0 |
| − | 13 8 1 0 0 0 0 | + | 13 8 1 0 0 0 0 |
| − | 12 14 1 0 0 0 0 | + | 12 14 1 0 0 0 0 |
| − | 14 15 2 0 0 0 0 | + | 14 15 2 0 0 0 0 |
| − | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
| − | 16 17 2 0 0 0 0 | + | 16 17 2 0 0 0 0 |
| − | 17 13 1 0 0 0 0 | + | 17 13 1 0 0 0 0 |
| − | 15 18 1 0 0 0 0 | + | 15 18 1 0 0 0 0 |
| − | 19 1 1 0 0 0 0 | + | 19 1 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FLIDWXNS0001 | + | ID FLIDWXNS0001 |
| − | KNApSAcK_ID C00002508 | + | KNApSAcK_ID C00002508 |
| − | NAME Anhydroglycinol;3,9-Dihydroxypterocarpene | + | NAME Anhydroglycinol;3,9-Dihydroxypterocarpene |
| − | CAS_RN 67685-22-7 | + | CAS_RN 67685-22-7 |
| − | FORMULA C15H10O4 | + | FORMULA C15H10O4 |
| − | EXACTMASS 254.05790880799998 | + | EXACTMASS 254.05790880799998 |
| − | AVERAGEMASS 254.2375 | + | AVERAGEMASS 254.2375 |
| − | SMILES Oc(c4)cc(O3)c(c4)c(o1)c(C3)c(c2)c(cc(O)c2)1 | + | SMILES Oc(c4)cc(O3)c(c4)c(o1)c(C3)c(c2)c(cc(O)c2)1 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
19 22 0 0 0 0 0 0 0 0999 V2000
-1.5484 0.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5484 0.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0480 0.1071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5475 0.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5475 0.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0480 1.2628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0471 0.1071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4534 0.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4534 0.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0471 1.2628 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0731 -0.4581 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6478 -0.5185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8828 0.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9874 -0.9860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5621 -0.9256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7972 -0.3977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4575 0.0698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9916 -1.3123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9916 1.3123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 2 0 0 0 0
3 4 1 0 0 0 0
4 5 2 0 0 0 0
5 6 1 0 0 0 0
6 1 2 0 0 0 0
4 7 1 0 0 0 0
7 8 2 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
7 11 1 0 0 0 0
11 12 1 0 0 0 0
12 13 2 0 0 0 0
13 8 1 0 0 0 0
12 14 1 0 0 0 0
14 15 2 0 0 0 0
15 16 1 0 0 0 0
16 17 2 0 0 0 0
17 13 1 0 0 0 0
15 18 1 0 0 0 0
19 1 1 0 0 0 0
S SKP 8
ID FLIDWXNS0001
KNApSAcK_ID C00002508
NAME Anhydroglycinol;3,9-Dihydroxypterocarpene
CAS_RN 67685-22-7
FORMULA C15H10O4
EXACTMASS 254.05790880799998
AVERAGEMASS 254.2375
SMILES Oc(c4)cc(O3)c(c4)c(o1)c(C3)c(c2)c(cc(O)c2)1
M END
