Mol:FL3FAANF0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 25 28 0 0 0 0 0 0 0 0999 V2000 | + | 25 28 0 0 0 0 0 0 0 0999 V2000 |
| − | -0.1764 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1764 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1764 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1764 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8909 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8909 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6054 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6054 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6054 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6054 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8909 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8909 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5380 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5380 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2525 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2525 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2525 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2525 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5380 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5380 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9670 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9670 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6814 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6814 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3959 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3959 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3959 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3959 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6814 1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6814 1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9670 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9670 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5380 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5380 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.1104 1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1104 1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8909 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8909 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3900 0.4612 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3900 0.4612 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8749 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8749 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3900 -0.8737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3900 -0.8737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6986 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6986 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.1104 -0.9195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.1104 -0.9195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.1104 0.5070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.1104 0.5070 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 |
| − | 14 18 1 0 0 0 0 | + | 14 18 1 0 0 0 0 |
| − | 6 19 1 0 0 0 0 | + | 6 19 1 0 0 0 0 |
| − | 4 20 1 0 0 0 0 | + | 4 20 1 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 22 5 1 0 0 0 0 | + | 22 5 1 0 0 0 0 |
| − | 21 23 1 0 0 0 0 | + | 21 23 1 0 0 0 0 |
| − | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
| − | 23 25 2 0 0 0 0 | + | 23 25 2 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FAANF0001 | + | ID FL3FAANF0001 |
| − | KNApSAcK_ID C00013450 | + | KNApSAcK_ID C00013450 |
| − | NAME Ciliatin A;(+)-2,3-dihydro-4-hydroxy-7-(4-hydroxyphenyl)-2-(1-methylethenyl)-5H-Furo[3,2-g][1]benzopyran-5-one | + | NAME Ciliatin A;(+)-2,3-dihydro-4-hydroxy-7-(4-hydroxyphenyl)-2-(1-methylethenyl)-5H-Furo[3,2-g][1]benzopyran-5-one |
| − | CAS_RN 539826-39-6 | + | CAS_RN 539826-39-6 |
| − | FORMULA C20H16O5 | + | FORMULA C20H16O5 |
| − | EXACTMASS 336.099773622 | + | EXACTMASS 336.099773622 |
| − | AVERAGEMASS 336.33804000000003 | + | AVERAGEMASS 336.33804000000003 |
| − | SMILES C(=O)(C=3)c(c(O)1)c(OC3c(c4)ccc(O)c4)cc(O2)c1CC2C(C)=C | + | SMILES C(=O)(C=3)c(c(O)1)c(OC3c(c4)ccc(O)c4)cc(O2)c1CC2C(C)=C |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
25 28 0 0 0 0 0 0 0 0999 V2000
-0.1764 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1764 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8909 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6054 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6054 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8909 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5380 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2525 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2525 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5380 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9670 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6814 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3959 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3959 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6814 1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9670 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5380 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1104 1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8909 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3900 0.4612 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8749 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3900 -0.8737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6986 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1104 -0.9195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1104 0.5070 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
14 18 1 0 0 0 0
6 19 1 0 0 0 0
4 20 1 0 0 0 0
20 21 1 0 0 0 0
21 22 1 0 0 0 0
22 5 1 0 0 0 0
21 23 1 0 0 0 0
23 24 1 0 0 0 0
23 25 2 0 0 0 0
S SKP 8
ID FL3FAANF0001
KNApSAcK_ID C00013450
NAME Ciliatin A;(+)-2,3-dihydro-4-hydroxy-7-(4-hydroxyphenyl)-2-(1-methylethenyl)-5H-Furo[3,2-g][1]benzopyran-5-one
CAS_RN 539826-39-6
FORMULA C20H16O5
EXACTMASS 336.099773622
AVERAGEMASS 336.33804000000003
SMILES C(=O)(C=3)c(c(O)1)c(OC3c(c4)ccc(O)c4)cc(O2)c1CC2C(C)=C
M END
