Mol:FL5FDAGS0006
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 34 37 0 0 0 0 0 0 0 0999 V2000 | + | 34 37 0 0 0 0 0 0 0 0999 V2000 |
| − | 2.6542 1.5622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6542 1.5622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6542 0.7372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6542 0.7372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3687 0.3247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3687 0.3247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.0832 0.7372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.0832 0.7372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.0832 1.5622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.0832 1.5622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3687 1.9747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3687 1.9747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9397 0.3247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9397 0.3247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2253 0.7372 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2253 0.7372 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5108 0.3247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5108 0.3247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5108 -0.5003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5108 -0.5003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2253 -0.9128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2253 -0.9128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9397 -0.5003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9397 -0.5003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2037 0.7372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2037 0.7372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9181 0.3247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9181 0.3247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9181 -0.5003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9181 -0.5003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2037 -0.9128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2037 -0.9128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2253 -1.6310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2253 -1.6310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6326 0.7372 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6326 0.7372 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6174 -0.9350 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6174 -0.9350 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.6839 1.9091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.6839 1.9091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2037 -1.6123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2037 -1.6123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3502 -0.5119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3502 -0.5119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8314 -1.9747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8314 -1.9747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.2007 0.9561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.2007 0.9561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.7880 0.2414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.7880 0.2414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9897 0.4505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9897 0.4505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1962 0.2237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1962 0.2237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6088 0.9384 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6088 0.9384 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.4072 0.7294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4072 0.7294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.5642 1.3152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5642 1.3152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.0440 1.5922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.0440 1.5922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.6839 0.4729 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.6839 0.4729 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.2367 0.5004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.2367 0.5004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1612 -0.1894 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1612 -0.1894 0.0000 O 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 |
| − | 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 18 1 0 0 0 0 | + | 14 18 1 0 0 0 0 |
| − | 11 17 2 0 0 0 0 | + | 11 17 2 0 0 0 0 |
| − | 12 19 1 0 0 0 0 | + | 12 19 1 0 0 0 0 |
| − | 5 20 1 0 0 0 0 | + | 5 20 1 0 0 0 0 |
| − | 16 21 1 0 0 0 0 | + | 16 21 1 0 0 0 0 |
| − | 19 22 1 0 0 0 0 | + | 19 22 1 0 0 0 0 |
| − | 21 23 1 0 0 0 0 | + | 21 23 1 0 0 0 0 |
| − | 24 25 1 1 0 0 0 | + | 24 25 1 1 0 0 0 |
| − | 25 26 1 1 0 0 0 | + | 25 26 1 1 0 0 0 |
| − | 27 26 1 1 0 0 0 | + | 27 26 1 1 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 |
| − | 29 24 1 0 0 0 0 | + | 29 24 1 0 0 0 0 |
| − | 29 30 1 0 0 0 0 | + | 29 30 1 0 0 0 0 |
| − | 30 31 1 0 0 0 0 | + | 30 31 1 0 0 0 0 |
| − | 24 32 1 0 0 0 0 | + | 24 32 1 0 0 0 0 |
| − | 25 33 1 0 0 0 0 | + | 25 33 1 0 0 0 0 |
| − | 26 34 1 0 0 0 0 | + | 26 34 1 0 0 0 0 |
| − | 18 27 1 0 0 0 0 | + | 18 27 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL5FDAGS0006 | + | ID FL5FDAGS0006 |
| − | KNApSAcK_ID C00013821 | + | KNApSAcK_ID C00013821 |
| − | NAME Kaempferol 3,5-dimethyl ether 7-glucoside;7-(beta-D-Glucopyranosyloxy)-2-(4-hydroxyphenyl)-3,5-dimethoxy-4H-1-benzopyran-4-one | + | NAME Kaempferol 3,5-dimethyl ether 7-glucoside;7-(beta-D-Glucopyranosyloxy)-2-(4-hydroxyphenyl)-3,5-dimethoxy-4H-1-benzopyran-4-one |
| − | CAS_RN 223920-19-2 | + | CAS_RN 223920-19-2 |
| − | FORMULA C23H24O11 | + | FORMULA C23H24O11 |
| − | EXACTMASS 476.13186161 | + | EXACTMASS 476.13186161 |
| − | AVERAGEMASS 476.43006 | + | AVERAGEMASS 476.43006 |
| − | SMILES C(C1O)(C(C(OC1Oc(c4)cc(OC)c(c42)C(C(=C(c(c3)ccc(c3)O)O2)OC)=O)CO)O)O | + | SMILES C(C1O)(C(C(OC1Oc(c4)cc(OC)c(c42)C(C(=C(c(c3)ccc(c3)O)O2)OC)=O)CO)O)O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
34 37 0 0 0 0 0 0 0 0999 V2000
2.6542 1.5622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6542 0.7372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3687 0.3247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0832 0.7372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0832 1.5622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3687 1.9747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9397 0.3247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2253 0.7372 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5108 0.3247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5108 -0.5003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2253 -0.9128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9397 -0.5003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2037 0.7372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9181 0.3247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9181 -0.5003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2037 -0.9128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2253 -1.6310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6326 0.7372 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6174 -0.9350 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6839 1.9091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2037 -1.6123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3502 -0.5119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8314 -1.9747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2007 0.9561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7880 0.2414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9897 0.4505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1962 0.2237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6088 0.9384 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.4072 0.7294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5642 1.3152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0440 1.5922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.6839 0.4729 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.2367 0.5004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1612 -0.1894 0.0000 O 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 18 1 0 0 0 0
11 17 2 0 0 0 0
12 19 1 0 0 0 0
5 20 1 0 0 0 0
16 21 1 0 0 0 0
19 22 1 0 0 0 0
21 23 1 0 0 0 0
24 25 1 1 0 0 0
25 26 1 1 0 0 0
27 26 1 1 0 0 0
27 28 1 0 0 0 0
28 29 1 0 0 0 0
29 24 1 0 0 0 0
29 30 1 0 0 0 0
30 31 1 0 0 0 0
24 32 1 0 0 0 0
25 33 1 0 0 0 0
26 34 1 0 0 0 0
18 27 1 0 0 0 0
S SKP 8
ID FL5FDAGS0006
KNApSAcK_ID C00013821
NAME Kaempferol 3,5-dimethyl ether 7-glucoside;7-(beta-D-Glucopyranosyloxy)-2-(4-hydroxyphenyl)-3,5-dimethoxy-4H-1-benzopyran-4-one
CAS_RN 223920-19-2
FORMULA C23H24O11
EXACTMASS 476.13186161
AVERAGEMASS 476.43006
SMILES C(C1O)(C(C(OC1Oc(c4)cc(OC)c(c42)C(C(=C(c(c3)ccc(c3)O)O2)OC)=O)CO)O)O
M END
