Mol:FL2F2CNP0001
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 32 0 0 0 0 0 0 0 0999 V2000 | + | 28 32 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.7190 -0.2982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7190 -0.2982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7190 -0.9406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7190 -0.9406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1627 -1.2618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1627 -1.2618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6064 -0.9406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6064 -0.9406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6064 -0.2982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6064 -0.2982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1627 0.0230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1627 0.0230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0501 -1.2618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0501 -1.2618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5062 -0.9406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5062 -0.9406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5062 -0.2982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5062 -0.2982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0501 0.0230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0501 0.0230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0623 0.0229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0623 0.0229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6293 -0.3045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6293 -0.3045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1963 0.0229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1963 0.0229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1963 0.6775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1963 0.6775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6293 1.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6293 1.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0623 0.6775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0623 0.6775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0501 -1.8055 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0501 -1.8055 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7631 1.0048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7631 1.0048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2751 0.0229 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2751 0.0229 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6293 1.6594 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6293 1.6594 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1627 0.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1627 0.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7188 0.9862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7188 0.9862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4473 1.8055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4473 1.8055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2751 0.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2751 0.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4404 1.2820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4404 1.2820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7631 0.5343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7631 0.5343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4335 -0.8491 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4335 -0.8491 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7190 -1.2616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7190 -1.2616 0.0000 C 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 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 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 |
| − | 14 18 1 0 0 0 0 | + | 14 18 1 0 0 0 0 |
| − | 1 19 1 0 0 0 0 | + | 1 19 1 0 0 0 0 |
| − | 15 20 1 0 0 0 0 | + | 15 20 1 0 0 0 0 |
| − | 6 21 1 0 0 0 0 | + | 6 21 1 0 0 0 0 |
| − | 21 22 2 0 0 0 0 | + | 21 22 2 0 0 0 0 |
| − | 20 23 1 0 0 0 0 | + | 20 23 1 0 0 0 0 |
| − | 23 18 1 0 0 0 0 | + | 23 18 1 0 0 0 0 |
| − | 22 24 1 0 0 0 0 | + | 22 24 1 0 0 0 0 |
| − | 24 19 1 0 0 0 0 | + | 24 19 1 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 24 26 1 0 0 0 0 | + | 24 26 1 0 0 0 0 |
| − | 2 27 1 0 0 0 0 | + | 2 27 1 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | M STY 1 1 SUP | + | M STY 1 1 SUP |
| − | M SLB 1 1 1 | + | M SLB 1 1 1 |
| − | M SAL 1 2 27 28 | + | M SAL 1 2 27 28 |
| − | M SBL 1 1 31 | + | M SBL 1 1 31 |
| − | M SMT 1 ^OCH3 | + | M SMT 1 ^OCH3 |
| − | M SBV 1 31 -8.1837 6.2076 | + | M SBV 1 31 -8.1837 6.2076 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2F2CNP0001 | + | ID FL2F2CNP0001 |
| − | KNApSAcK_ID C00008288 | + | KNApSAcK_ID C00008288 |
| − | NAME Ovalichromene A | + | NAME Ovalichromene A |
| − | CAS_RN 62868-04-6 | + | CAS_RN 62868-04-6 |
| − | FORMULA C22H20O6 | + | FORMULA C22H20O6 |
| − | EXACTMASS 380.125988372 | + | EXACTMASS 380.125988372 |
| − | AVERAGEMASS 380.3906 | + | AVERAGEMASS 380.3906 |
| − | SMILES c(O5)(c4OC5)cc(cc4)C(O1)CC(c(c3)c(c(c(c3OC)2)C=CC(O2)(C)C)1)=O | + | SMILES c(O5)(c4OC5)cc(cc4)C(O1)CC(c(c3)c(c(c(c3OC)2)C=CC(O2)(C)C)1)=O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
28 32 0 0 0 0 0 0 0 0999 V2000
-1.7190 -0.2982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7190 -0.9406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1627 -1.2618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6064 -0.9406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6064 -0.2982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1627 0.0230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0501 -1.2618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5062 -0.9406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5062 -0.2982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0501 0.0230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0623 0.0229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6293 -0.3045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1963 0.0229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1963 0.6775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6293 1.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0623 0.6775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0501 -1.8055 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7631 1.0048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2751 0.0229 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6293 1.6594 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1627 0.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7188 0.9862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4473 1.8055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2751 0.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4404 1.2820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7631 0.5343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4335 -0.8491 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7190 -1.2616 0.0000 C 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 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 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
14 18 1 0 0 0 0
1 19 1 0 0 0 0
15 20 1 0 0 0 0
6 21 1 0 0 0 0
21 22 2 0 0 0 0
20 23 1 0 0 0 0
23 18 1 0 0 0 0
22 24 1 0 0 0 0
24 19 1 0 0 0 0
24 25 1 0 0 0 0
24 26 1 0 0 0 0
2 27 1 0 0 0 0
27 28 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 27 28
M SBL 1 1 31
M SMT 1 ^OCH3
M SBV 1 31 -8.1837 6.2076
S SKP 8
ID FL2F2CNP0001
KNApSAcK_ID C00008288
NAME Ovalichromene A
CAS_RN 62868-04-6
FORMULA C22H20O6
EXACTMASS 380.125988372
AVERAGEMASS 380.3906
SMILES c(O5)(c4OC5)cc(cc4)C(O1)CC(c(c3)c(c(c(c3OC)2)C=CC(O2)(C)C)1)=O
M END
