Mol:FL5FAICS0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 36 39 0 0 0 0 0 0 0 0999 V2000 | + | 36 39 0 0 0 0 0 0 0 0999 V2000 |
| − | 1.9841 0.8534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9841 0.8534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9841 0.0284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9841 0.0284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6986 -0.3841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6986 -0.3841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4131 0.0284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4131 0.0284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4131 0.8534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4131 0.8534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6986 1.2659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6986 1.2659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2304 -0.4067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2304 -0.4067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5160 0.0058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5160 0.0058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1985 -0.4067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1985 -0.4067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1985 -1.2317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1985 -1.2317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5160 -1.6442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5160 -1.6442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2304 -1.2317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2304 -1.2317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | -1.6274 -0.4067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6274 -0.4067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6274 -1.2317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6274 -1.2317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9130 -1.6442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9130 -1.6442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2985 -0.0193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2985 -0.0193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9130 -2.3837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9130 -2.3837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5160 -2.2163 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5160 -2.2163 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.1128 1.2574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1128 1.2574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8816 -1.6076 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8816 -1.6076 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.3209 -1.0465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.3209 -1.0465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.8669 -1.7357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8669 -1.7357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0823 -1.4799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0823 -1.4799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2768 -1.6598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2768 -1.6598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7307 -0.9705 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7307 -0.9705 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.5154 -1.2261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5154 -1.2261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.7066 -0.6506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.7066 -0.6506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.2019 -0.4022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.2019 -0.4022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.7748 -1.5572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.7748 -1.5572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.3063 -1.6179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.3063 -1.6179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2158 -2.1289 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2158 -2.1289 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6986 2.0257 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6986 2.0257 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3187 2.3837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3187 2.3837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.0994 -0.3678 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.0994 -0.3678 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.7748 0.0221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.7748 0.0221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | 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 |
| − | 2 7 1 0 0 0 0 | + | 2 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 2 0 0 0 0 | + | 9 10 2 0 0 0 0 |
| − | 10 11 1 0 0 0 0 | + | 10 11 1 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 12 7 2 0 0 0 0 | + | 12 7 2 0 0 0 0 |
| − | 9 13 1 0 0 0 0 | + | 9 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 10 1 0 0 0 0 | + | 16 10 1 0 0 0 0 |
| − | 14 17 1 0 0 0 0 | + | 14 17 1 0 0 0 0 |
| − | 16 18 1 0 0 0 0 | + | 16 18 1 0 0 0 0 |
| − | 11 19 2 0 0 0 0 | + | 11 19 2 0 0 0 0 |
| − | 5 20 1 0 0 0 0 | + | 5 20 1 0 0 0 0 |
| − | 12 21 1 0 0 0 0 | + | 12 21 1 0 0 0 0 |
| − | 22 23 1 1 0 0 0 | + | 22 23 1 1 0 0 0 |
| − | 23 24 1 1 0 0 0 | + | 23 24 1 1 0 0 0 |
| − | 25 24 1 1 0 0 0 | + | 25 24 1 1 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
| − | 27 22 1 0 0 0 0 | + | 27 22 1 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | 28 29 1 0 0 0 0 | + | 28 29 1 0 0 0 0 |
| − | 22 30 1 0 0 0 0 | + | 22 30 1 0 0 0 0 |
| − | 23 31 1 0 0 0 0 | + | 23 31 1 0 0 0 0 |
| − | 24 32 1 0 0 0 0 | + | 24 32 1 0 0 0 0 |
| − | 6 33 1 0 0 0 0 | + | 6 33 1 0 0 0 0 |
| − | 33 34 1 0 0 0 0 | + | 33 34 1 0 0 0 0 |
| − | 4 35 1 0 0 0 0 | + | 4 35 1 0 0 0 0 |
| − | 35 36 1 0 0 0 0 | + | 35 36 1 0 0 0 0 |
| − | 25 15 1 0 0 0 0 | + | 25 15 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL5FAICS0001 | + | ID FL5FAICS0001 |
| − | KNApSAcK_ID C00014022 | + | KNApSAcK_ID C00014022 |
| − | NAME Moghanin A;6-beta-D-Glucopyranosyl-3,5,7-trihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4H-1-benzopyran-4-one | + | NAME Moghanin A;6-beta-D-Glucopyranosyl-3,5,7-trihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4H-1-benzopyran-4-one |
| − | CAS_RN 194782-36-0 | + | CAS_RN 194782-36-0 |
| − | FORMULA C23H24O13 | + | FORMULA C23H24O13 |
| − | EXACTMASS 508.121690854 | + | EXACTMASS 508.121690854 |
| − | AVERAGEMASS 508.42886 | + | AVERAGEMASS 508.42886 |
| − | SMILES c(c1)(O)c(C(C(O)4)OC(C(C4O)O)CO)c(O)c(C3=O)c(OC(=C3O)c(c2)cc(c(c(OC)2)O)OC)1 | + | SMILES c(c1)(O)c(C(C(O)4)OC(C(C4O)O)CO)c(O)c(C3=O)c(OC(=C3O)c(c2)cc(c(c(OC)2)O)OC)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/
36 39 0 0 0 0 0 0 0 0999 V2000
1.9841 0.8534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9841 0.0284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6986 -0.3841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4131 0.0284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4131 0.8534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6986 1.2659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2304 -0.4067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5160 0.0058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1985 -0.4067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1985 -1.2317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5160 -1.6442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2304 -1.2317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9130 0.0058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6274 -0.4067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6274 -1.2317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9130 -1.6442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2985 -0.0193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9130 -2.3837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5160 -2.2163 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1128 1.2574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8816 -1.6076 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.3209 -1.0465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8669 -1.7357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0823 -1.4799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2768 -1.6598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7307 -0.9705 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5154 -1.2261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7066 -0.6506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2019 -0.4022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.7748 -1.5572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.3063 -1.6179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2158 -2.1289 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6986 2.0257 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3187 2.3837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0994 -0.3678 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.7748 0.0221 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
2 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 2 0 0 0 0
10 11 1 0 0 0 0
11 12 1 0 0 0 0
12 7 2 0 0 0 0
9 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 10 1 0 0 0 0
14 17 1 0 0 0 0
16 18 1 0 0 0 0
11 19 2 0 0 0 0
5 20 1 0 0 0 0
12 21 1 0 0 0 0
22 23 1 1 0 0 0
23 24 1 1 0 0 0
25 24 1 1 0 0 0
25 26 1 0 0 0 0
26 27 1 0 0 0 0
27 22 1 0 0 0 0
27 28 1 0 0 0 0
28 29 1 0 0 0 0
22 30 1 0 0 0 0
23 31 1 0 0 0 0
24 32 1 0 0 0 0
6 33 1 0 0 0 0
33 34 1 0 0 0 0
4 35 1 0 0 0 0
35 36 1 0 0 0 0
25 15 1 0 0 0 0
S SKP 8
ID FL5FAICS0001
KNApSAcK_ID C00014022
NAME Moghanin A;6-beta-D-Glucopyranosyl-3,5,7-trihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4H-1-benzopyran-4-one
CAS_RN 194782-36-0
FORMULA C23H24O13
EXACTMASS 508.121690854
AVERAGEMASS 508.42886
SMILES c(c1)(O)c(C(C(O)4)OC(C(C4O)O)CO)c(O)c(C3=O)c(OC(=C3O)c(c2)cc(c(c(OC)2)O)OC)1
M END
