Mol:FL5FAJGA0002
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 35 38 0 0 0 0 0 0 0 0999 V2000 | + | 35 38 0 0 0 0 0 0 0 0999 V2000 |
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| − | -1.3194 -0.2395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3194 -0.2395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3194 0.5296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3194 0.5296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | 0.0128 -0.2395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0128 -0.2395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0128 0.5296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0128 0.5296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6533 0.9142 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6533 0.9142 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7497 0.9551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7497 0.9551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3974 0.5811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3974 0.5811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0451 0.9551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0451 0.9551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0451 1.7030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0451 1.7030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3974 2.0769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3974 2.0769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7497 1.7030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7497 1.7030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3440 0.9294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3440 0.9294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9855 -1.3008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9855 -1.3008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6533 -1.2028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6533 -1.2028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3974 2.6924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3974 2.6924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6182 0.6242 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6182 0.6242 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6322 2.0419 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6322 2.0419 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6534 -0.6094 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6534 -0.6094 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3440 2.0419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3440 2.0419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2990 -2.2568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2990 -2.2568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5984 -2.6924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5984 -2.6924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0068 -2.1317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0068 -2.1317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8133 -1.9578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8133 -1.9578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1127 -1.5221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1127 -1.5221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4926 -2.0827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4926 -2.0827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8678 -1.6822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8678 -1.6822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3044 -1.6679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3044 -1.6679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6590 -2.0490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6590 -2.0490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | -0.0114 -2.6897 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0114 -2.6897 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 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 3 1 0 0 0 0 | + | 10 3 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 |
| − | 5 17 1 0 0 0 0 | + | 5 17 1 0 0 0 0 |
| − | 1 18 1 0 0 0 0 | + | 1 18 1 0 0 0 0 |
| − | 7 19 2 0 0 0 0 | + | 7 19 2 0 0 0 0 |
| − | 15 20 1 0 0 0 0 | + | 15 20 1 0 0 0 0 |
| − | 13 21 1 0 0 0 0 | + | 13 21 1 0 0 0 0 |
| − | 14 22 1 0 0 0 0 | + | 14 22 1 0 0 0 0 |
| − | 8 23 1 0 0 0 0 | + | 8 23 1 0 0 0 0 |
| − | 22 24 1 0 0 0 0 | + | 22 24 1 0 0 0 0 |
| − | 25 26 1 1 0 0 0 | + | 25 26 1 1 0 0 0 |
| − | 26 27 1 1 0 0 0 | + | 26 27 1 1 0 0 0 |
| − | 28 27 1 1 0 0 0 | + | 28 27 1 1 0 0 0 |
| − | 28 29 1 0 0 0 0 | + | 28 29 1 0 0 0 0 |
| − | 29 30 1 0 0 0 0 | + | 29 30 1 0 0 0 0 |
| − | 30 25 1 0 0 0 0 | + | 30 25 1 0 0 0 0 |
| − | 30 31 1 0 0 0 0 | + | 30 31 1 0 0 0 0 |
| − | 31 32 1 0 0 0 0 | + | 31 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 |
| − | 27 35 1 0 0 0 0 | + | 27 35 1 0 0 0 0 |
| − | 23 28 1 0 0 0 0 | + | 23 28 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL5FAJGA0002 | + | ID FL5FAJGA0002 |
| − | KNApSAcK_ID C00011180 | + | KNApSAcK_ID C00011180 |
| − | NAME Myricetin 4'-methyl ether 3-O-beta-D-galactopyranoside;2-(3,5-Dihydroxy-4-methoxyphenyl)-3-(beta-D-galactopyranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one | + | NAME Myricetin 4'-methyl ether 3-O-beta-D-galactopyranoside;2-(3,5-Dihydroxy-4-methoxyphenyl)-3-(beta-D-galactopyranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one |
| − | CAS_RN 230283-36-0 | + | CAS_RN 230283-36-0 |
| − | FORMULA C22H22O13 | + | FORMULA C22H22O13 |
| − | EXACTMASS 494.10604078999995 | + | EXACTMASS 494.10604078999995 |
| − | AVERAGEMASS 494.40228 | + | AVERAGEMASS 494.40228 |
| − | SMILES c(C(=O)1)(c4O)c(cc(c4)O)OC(c(c3)cc(c(OC)c(O)3)O)=C1OC(O2)C(O)C(C(C(CO)2)O)O | + | SMILES c(C(=O)1)(c4O)c(cc(c4)O)OC(c(c3)cc(c(OC)c(O)3)O)=C1OC(O2)C(O)C(C(C(CO)2)O)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/
35 38 0 0 0 0 0 0 0 0999 V2000
-1.9855 -0.6241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3194 -0.2395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3194 0.5296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9855 0.9142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6516 0.5296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6516 -0.2395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6533 -0.6241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0128 -0.2395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0128 0.5296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6533 0.9142 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7497 0.9551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3974 0.5811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0451 0.9551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0451 1.7030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3974 2.0769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7497 1.7030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3440 0.9294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9855 -1.3008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6533 -1.2028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3974 2.6924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6182 0.6242 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6322 2.0419 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6534 -0.6094 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3440 2.0419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2990 -2.2568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5984 -2.6924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0068 -2.1317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8133 -1.9578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1127 -1.5221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4926 -2.0827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8678 -1.6822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3044 -1.6679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6590 -2.0490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0483 -2.6777 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0114 -2.6897 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 2 0 0 0 0
9 10 1 0 0 0 0
10 3 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
5 17 1 0 0 0 0
1 18 1 0 0 0 0
7 19 2 0 0 0 0
15 20 1 0 0 0 0
13 21 1 0 0 0 0
14 22 1 0 0 0 0
8 23 1 0 0 0 0
22 24 1 0 0 0 0
25 26 1 1 0 0 0
26 27 1 1 0 0 0
28 27 1 1 0 0 0
28 29 1 0 0 0 0
29 30 1 0 0 0 0
30 25 1 0 0 0 0
30 31 1 0 0 0 0
31 32 1 0 0 0 0
25 33 1 0 0 0 0
26 34 1 0 0 0 0
27 35 1 0 0 0 0
23 28 1 0 0 0 0
S SKP 8
ID FL5FAJGA0002
KNApSAcK_ID C00011180
NAME Myricetin 4'-methyl ether 3-O-beta-D-galactopyranoside;2-(3,5-Dihydroxy-4-methoxyphenyl)-3-(beta-D-galactopyranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one
CAS_RN 230283-36-0
FORMULA C22H22O13
EXACTMASS 494.10604078999995
AVERAGEMASS 494.40228
SMILES c(C(=O)1)(c4O)c(cc(c4)O)OC(c(c3)cc(c(OC)c(O)3)O)=C1OC(O2)C(O)C(C(C(CO)2)O)O
M END
