Mol:FL2F1ANP0005
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 29 32 0 0 0 0 0 0 0 0999 V2000 | + | 29 32 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.1811 -1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1811 -1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6602 -1.3938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6602 -1.3938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1393 -1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1393 -1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1393 -0.4916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1393 -0.4916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6602 -0.1909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6602 -0.1909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1811 -0.4916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1811 -0.4916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6184 -1.3938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6184 -1.3938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0976 -1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0976 -1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0976 -0.4916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0976 -0.4916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6184 -0.1909 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6184 -0.1909 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4228 -0.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4228 -0.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6184 -1.9177 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6184 -1.9177 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9572 -0.4997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9572 -0.4997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4915 -0.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4915 -0.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4915 0.4259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4915 0.4259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9572 0.7344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9572 0.7344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4228 0.4259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4228 0.4259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7020 -0.1909 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7020 -0.1909 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6602 0.4100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6602 0.4100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1806 0.7104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1806 0.7104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1806 1.3113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1806 1.3113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7010 1.6117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7010 1.6117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6602 1.6117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6602 1.6117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0259 0.7344 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0259 0.7344 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0259 1.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0259 1.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4915 1.6599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4915 1.6599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9572 1.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9572 1.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7020 1.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7020 1.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3529 1.9177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3529 1.9177 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 |
| − | 3 7 1 0 0 0 0 | + | 3 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 4 1 0 0 0 0 | + | 10 4 1 0 0 0 0 |
| − | 9 11 1 0 0 0 0 | + | 9 11 1 0 0 0 0 |
| − | 7 12 2 0 0 0 0 | + | 7 12 2 0 0 0 0 |
| − | 11 13 2 0 0 0 0 | + | 11 13 2 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 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 11 1 0 0 0 0 | + | 17 11 1 0 0 0 0 |
| − | 6 18 1 0 0 0 0 | + | 6 18 1 0 0 0 0 |
| − | 5 19 1 0 0 0 0 | + | 5 19 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 |
| − | 15 24 1 0 0 0 0 | + | 15 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 27 2 0 0 0 0 | + | 26 27 2 0 0 0 0 |
| − | 27 16 1 0 0 0 0 | + | 27 16 1 0 0 0 0 |
| − | 25 28 1 0 0 0 0 | + | 25 28 1 0 0 0 0 |
| − | 25 29 1 0 0 0 0 | + | 25 29 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2F1ANP0005 | + | ID FL2F1ANP0005 |
| − | KNApSAcK_ID C00008458 | + | KNApSAcK_ID C00008458 |
| − | NAME Euchrenone a5 | + | NAME Euchrenone a5 |
| − | CAS_RN 125140-20-7 | + | CAS_RN 125140-20-7 |
| − | FORMULA C25H26O4 | + | FORMULA C25H26O4 |
| − | EXACTMASS 390.18310931999997 | + | EXACTMASS 390.18310931999997 |
| − | AVERAGEMASS 390.47153999999995 | + | AVERAGEMASS 390.47153999999995 |
| − | SMILES c(O2)(c1C(CC2c(c4)ccc(c43)OC(C=C3)(C)C)=O)c(CC=C(C)C)c(cc1)O | + | SMILES c(O2)(c1C(CC2c(c4)ccc(c43)OC(C=C3)(C)C)=O)c(CC=C(C)C)c(cc1)O |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
29 32 0 0 0 0 0 0 0 0999 V2000
-2.1811 -1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6602 -1.3938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1393 -1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1393 -0.4916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6602 -0.1909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1811 -0.4916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6184 -1.3938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0976 -1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0976 -0.4916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6184 -0.1909 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4228 -0.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6184 -1.9177 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9572 -0.4997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4915 -0.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4915 0.4259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9572 0.7344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4228 0.4259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7020 -0.1909 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6602 0.4100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1806 0.7104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1806 1.3113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7010 1.6117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6602 1.6117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0259 0.7344 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0259 1.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4915 1.6599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9572 1.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7020 1.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3529 1.9177 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
3 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 4 1 0 0 0 0
9 11 1 0 0 0 0
7 12 2 0 0 0 0
11 13 2 0 0 0 0
13 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 11 1 0 0 0 0
6 18 1 0 0 0 0
5 19 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
15 24 1 0 0 0 0
24 25 1 0 0 0 0
25 26 1 0 0 0 0
26 27 2 0 0 0 0
27 16 1 0 0 0 0
25 28 1 0 0 0 0
25 29 1 0 0 0 0
S SKP 8
ID FL2F1ANP0005
KNApSAcK_ID C00008458
NAME Euchrenone a5
CAS_RN 125140-20-7
FORMULA C25H26O4
EXACTMASS 390.18310931999997
AVERAGEMASS 390.47153999999995
SMILES c(O2)(c1C(CC2c(c4)ccc(c43)OC(C=C3)(C)C)=O)c(CC=C(C)C)c(cc1)O
M END
