Mol:FL3FA8GS0005
From Metabolomics.JP
(Difference between revisions)
| Line 1: | Line 1: | ||
| − | + | ||
| − | + | ||
| − | 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 |
| − | -1.8858 1.1656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8858 1.1656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8858 0.3406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8858 0.3406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1714 -0.0719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1714 -0.0719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4569 0.3406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4569 0.3406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4569 1.1656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4569 1.1656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1714 1.5781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1714 1.5781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2576 -0.0719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2576 -0.0719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9721 0.3406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9721 0.3406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9721 1.1656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9721 1.1656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2576 1.5781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2576 1.5781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6865 1.5781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6865 1.5781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4010 1.1656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4010 1.1656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1155 1.5781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1155 1.5781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1155 2.4031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1155 2.4031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4010 2.8156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4010 2.8156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6865 2.4031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6865 2.4031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2576 -0.8969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2576 -0.8969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1714 -0.8969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1714 -0.8969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6003 1.5781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6003 1.5781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4010 0.3898 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4010 0.3898 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3009 1.1736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3009 1.1736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4519 -2.0476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4519 -2.0476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2659 -2.1835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2659 -2.1835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6120 -1.4343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6120 -1.4343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2916 -0.9661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2916 -0.9661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4776 -0.8301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4776 -0.8301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1314 -1.5793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1314 -1.5793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3009 -1.5493 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3009 -1.5493 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6850 -2.4009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6850 -2.4009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3236 -2.8156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3236 -2.8156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6560 -1.3628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6560 -1.3628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2372 -1.5196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2372 -1.5196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2431 -1.3771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2431 -1.3771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8052 -1.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8052 -1.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8987 -0.6065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8987 -0.6065 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 |
| − | 4 7 1 0 0 0 0 | + | 4 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 5 1 0 0 0 0 | + | 10 5 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 |
| − | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
| − | 1 19 1 0 0 0 0 | + | 1 19 1 0 0 0 0 |
| − | 12 20 1 0 0 0 0 | + | 12 20 1 0 0 0 0 |
| − | 19 21 1 0 0 0 0 | + | 19 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 |
| − | 24 28 1 0 0 0 0 | + | 24 28 1 0 0 0 0 |
| − | 23 29 1 0 0 0 0 | + | 23 29 1 0 0 0 0 |
| − | 22 30 1 0 0 0 0 | + | 22 30 1 0 0 0 0 |
| − | 27 31 1 0 0 0 0 | + | 27 31 1 0 0 0 0 |
| − | 31 32 1 0 0 0 0 | + | 31 32 1 0 0 0 0 |
| − | 32 34 1 0 0 0 0 | + | 32 34 1 0 0 0 0 |
| − | 33 34 2 0 0 0 0 | + | 33 34 2 0 0 0 0 |
| − | 34 35 1 0 0 0 0 | + | 34 35 1 0 0 0 0 |
| − | 25 20 1 0 0 0 0 | + | 25 20 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FA8GS0005 | + | ID FL3FA8GS0005 |
| − | KNApSAcK_ID C00013606 | + | KNApSAcK_ID C00013606 |
| − | NAME Echioidinin 2'-(6''-acetylglucoside);5,2'-Dihydroxy-7-methoxyflavone 2'-(6''-acetylglucoside);2-[2-[(6-O-Acetyl-beta-D-glucopyranosyl)oxy]phenyl]-5-hydroxy-7-methoxy-4H-1-benzopyran-4-one | + | NAME Echioidinin 2'-(6''-acetylglucoside);5,2'-Dihydroxy-7-methoxyflavone 2'-(6''-acetylglucoside);2-[2-[(6-O-Acetyl-beta-D-glucopyranosyl)oxy]phenyl]-5-hydroxy-7-methoxy-4H-1-benzopyran-4-one |
| − | CAS_RN 497918-32-8 | + | CAS_RN 497918-32-8 |
| − | FORMULA C24H24O11 | + | FORMULA C24H24O11 |
| − | EXACTMASS 488.13186161 | + | EXACTMASS 488.13186161 |
| − | AVERAGEMASS 488.44076 | + | AVERAGEMASS 488.44076 |
| − | SMILES C(C1O)(C(COC(C)=O)OC(Oc(c2C(O4)=CC(c(c34)c(cc(c3)OC)O)=O)cccc2)C1O)O | + | SMILES C(C1O)(C(COC(C)=O)OC(Oc(c2C(O4)=CC(c(c34)c(cc(c3)OC)O)=O)cccc2)C1O)O |
M END | M END | ||
| − | |||
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
-1.8858 1.1656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8858 0.3406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1714 -0.0719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4569 0.3406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4569 1.1656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1714 1.5781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2576 -0.0719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9721 0.3406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9721 1.1656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2576 1.5781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6865 1.5781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4010 1.1656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1155 1.5781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1155 2.4031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4010 2.8156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6865 2.4031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2576 -0.8969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1714 -0.8969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6003 1.5781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4010 0.3898 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.3009 1.1736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4519 -2.0476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2659 -2.1835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6120 -1.4343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2916 -0.9661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4776 -0.8301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1314 -1.5793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3009 -1.5493 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6850 -2.4009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3236 -2.8156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6560 -1.3628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2372 -1.5196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2431 -1.3771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8052 -1.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8987 -0.6065 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
4 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 5 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
3 18 1 0 0 0 0
1 19 1 0 0 0 0
12 20 1 0 0 0 0
19 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
24 28 1 0 0 0 0
23 29 1 0 0 0 0
22 30 1 0 0 0 0
27 31 1 0 0 0 0
31 32 1 0 0 0 0
32 34 1 0 0 0 0
33 34 2 0 0 0 0
34 35 1 0 0 0 0
25 20 1 0 0 0 0
S SKP 8
ID FL3FA8GS0005
KNApSAcK_ID C00013606
NAME Echioidinin 2'-(6''-acetylglucoside);5,2'-Dihydroxy-7-methoxyflavone 2'-(6''-acetylglucoside);2-[2-[(6-O-Acetyl-beta-D-glucopyranosyl)oxy]phenyl]-5-hydroxy-7-methoxy-4H-1-benzopyran-4-one
CAS_RN 497918-32-8
FORMULA C24H24O11
EXACTMASS 488.13186161
AVERAGEMASS 488.44076
SMILES C(C1O)(C(COC(C)=O)OC(Oc(c2C(O4)=CC(c(c34)c(cc(c3)OC)O)=O)cccc2)C1O)O
M END
