Mol:FL5FACGS0116
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 66 72 0 0 0 0 0 0 0 0999 V2000 | + | 66 72 0 0 0 0 0 0 0 0999 V2000 |
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| − | 37 38 1 0 0 0 0 | + | 37 38 1 0 0 0 0 |
| − | 38 33 1 0 0 0 0 | + | 38 33 1 0 0 0 0 |
| − | 38 39 1 0 0 0 0 | + | 38 39 1 0 0 0 0 |
| − | 39 40 1 0 0 0 0 | + | 39 40 1 0 0 0 0 |
| − | 33 41 1 0 0 0 0 | + | 33 41 1 0 0 0 0 |
| − | 34 42 1 0 0 0 0 | + | 34 42 1 0 0 0 0 |
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| − | 44 45 1 1 0 0 0 | + | 44 45 1 1 0 0 0 |
| − | 45 46 1 1 0 0 0 | + | 45 46 1 1 0 0 0 |
| − | 47 46 1 1 0 0 0 | + | 47 46 1 1 0 0 0 |
| − | 47 48 1 0 0 0 0 | + | 47 48 1 0 0 0 0 |
| − | 48 49 1 0 0 0 0 | + | 48 49 1 0 0 0 0 |
| − | 49 44 1 0 0 0 0 | + | 49 44 1 0 0 0 0 |
| − | 49 50 1 0 0 0 0 | + | 49 50 1 0 0 0 0 |
| − | 50 51 1 0 0 0 0 | + | 50 51 1 0 0 0 0 |
| − | 44 52 1 0 0 0 0 | + | 44 52 1 0 0 0 0 |
| − | 45 53 1 0 0 0 0 | + | 45 53 1 0 0 0 0 |
| − | 46 54 1 0 0 0 0 | + | 46 54 1 0 0 0 0 |
| − | 47 43 1 0 0 0 0 | + | 47 43 1 0 0 0 0 |
| − | 36 19 1 0 0 0 0 | + | 36 19 1 0 0 0 0 |
| − | 55 56 2 0 0 0 0 | + | 55 56 2 0 0 0 0 |
| − | 55 57 1 0 0 0 0 | + | 55 57 1 0 0 0 0 |
| − | 57 58 2 0 0 0 0 | + | 57 58 2 0 0 0 0 |
| − | 58 59 1 0 0 0 0 | + | 58 59 1 0 0 0 0 |
| − | 59 60 2 0 0 0 0 | + | 59 60 2 0 0 0 0 |
| − | 60 61 1 0 0 0 0 | + | 60 61 1 0 0 0 0 |
| − | 61 62 2 0 0 0 0 | + | 61 62 2 0 0 0 0 |
| − | 62 63 1 0 0 0 0 | + | 62 63 1 0 0 0 0 |
| − | 63 64 2 0 0 0 0 | + | 63 64 2 0 0 0 0 |
| − | 64 59 1 0 0 0 0 | + | 64 59 1 0 0 0 0 |
| − | 62 65 1 0 0 0 0 | + | 62 65 1 0 0 0 0 |
| − | 61 66 1 0 0 0 0 | + | 61 66 1 0 0 0 0 |
| − | 40 55 1 0 0 0 0 | + | 40 55 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL5FACGS0116 | + | ID FL5FACGS0116 |
| − | FORMULA C42H46O24 | + | FORMULA C42H46O24 |
| − | EXACTMASS 934.2379024 | + | EXACTMASS 934.2379024 |
| − | AVERAGEMASS 934.8002399999999 | + | AVERAGEMASS 934.8002399999999 |
| − | SMILES C(C(O)1)(O)C(O)C(C)OC1Oc(c7)cc(O)c(c75)C(=O)C(=C(c(c6)ccc(O)c6O)O5)OC(O3)C(C(C(C3COC(C=Cc(c4)cc(c(O)c4)O)=O)O)O)OC(C2O)OC(C(C2O)O)CO | + | SMILES C(C(O)1)(O)C(O)C(C)OC1Oc(c7)cc(O)c(c75)C(=O)C(=C(c(c6)ccc(O)c6O)O5)OC(O3)C(C(C(C3COC(C=Cc(c4)cc(c(O)c4)O)=O)O)O)OC(C2O)OC(C(C2O)O)CO |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
66 72 0 0 0 0 0 0 0 0999 V2000
3.3819 1.8068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6674 2.2193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6674 3.0442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3819 3.4567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0964 3.0442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0964 2.2193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9530 1.8068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2386 2.2193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5241 1.8068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5241 0.9818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2386 0.5693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9530 0.9818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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25 30 1 0 0 0 0
24 31 1 0 0 0 0
23 32 1 0 0 0 0
27 18 1 0 0 0 0
33 34 1 1 0 0 0
34 35 1 1 0 0 0
36 35 1 1 0 0 0
36 37 1 0 0 0 0
37 38 1 0 0 0 0
38 33 1 0 0 0 0
38 39 1 0 0 0 0
39 40 1 0 0 0 0
33 41 1 0 0 0 0
34 42 1 0 0 0 0
35 43 1 0 0 0 0
44 45 1 1 0 0 0
45 46 1 1 0 0 0
47 46 1 1 0 0 0
47 48 1 0 0 0 0
48 49 1 0 0 0 0
49 44 1 0 0 0 0
49 50 1 0 0 0 0
50 51 1 0 0 0 0
44 52 1 0 0 0 0
45 53 1 0 0 0 0
46 54 1 0 0 0 0
47 43 1 0 0 0 0
36 19 1 0 0 0 0
55 56 2 0 0 0 0
55 57 1 0 0 0 0
57 58 2 0 0 0 0
58 59 1 0 0 0 0
59 60 2 0 0 0 0
60 61 1 0 0 0 0
61 62 2 0 0 0 0
62 63 1 0 0 0 0
63 64 2 0 0 0 0
64 59 1 0 0 0 0
62 65 1 0 0 0 0
61 66 1 0 0 0 0
40 55 1 0 0 0 0
S SKP 5
ID FL5FACGS0116
FORMULA C42H46O24
EXACTMASS 934.2379024
AVERAGEMASS 934.8002399999999
SMILES C(C(O)1)(O)C(O)C(C)OC1Oc(c7)cc(O)c(c75)C(=O)C(=C(c(c6)ccc(O)c6O)O5)OC(O3)C(C(C(C3COC(C=Cc(c4)cc(c(O)c4)O)=O)O)O)OC(C2O)OC(C(C2O)O)CO
M END
