Mol:FL3FBCCS0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 33 36 0 0 0 0 0 0 0 0999 V2000 | + | 33 36 0 0 0 0 0 0 0 0999 V2000 |
| − | 1.0537 0.5662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0537 0.5662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0537 -0.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0537 -0.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7682 -0.6713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7682 -0.6713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4827 -0.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4827 -0.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4827 0.5662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4827 0.5662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7682 0.9787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7682 0.9787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3000 -0.6939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3000 -0.6939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4144 -0.2814 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4144 -0.2814 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1289 -0.6939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1289 -0.6939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1289 -1.5189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1289 -1.5189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4144 -1.9314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4144 -1.9314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3000 -1.5189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3000 -1.5189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8434 -0.2814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8434 -0.2814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5578 -0.6939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5578 -0.6939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5578 -1.5189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5578 -1.5189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8434 -1.9314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8434 -1.9314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2289 -0.3065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2289 -0.3065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8434 -2.6709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8434 -2.6709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4144 -2.5035 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4144 -2.5035 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0941 0.9192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0941 0.9192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2289 -0.6896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2289 -0.6896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5338 -3.0696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5338 -3.0696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7777 2.6252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7777 2.6252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4583 2.1585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4583 2.1585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1879 1.3787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1879 1.3787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3526 0.5701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3526 0.5701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6720 1.0368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6720 1.0368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9423 1.8166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9423 1.8166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3704 2.0185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3704 2.0185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1313 2.5183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1313 2.5183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2969 3.0696 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2969 3.0696 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2348 2.6259 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2348 2.6259 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8392 1.5001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8392 1.5001 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 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 |
| − | 4 21 1 0 0 0 0 | + | 4 21 1 0 0 0 0 |
| − | 18 22 1 0 0 0 0 | + | 18 22 1 0 0 0 0 |
| − | 23 24 1 1 0 0 0 | + | 23 24 1 1 0 0 0 |
| − | 24 25 1 1 0 0 0 | + | 24 25 1 1 0 0 0 |
| − | 26 25 1 1 0 0 0 | + | 26 25 1 1 0 0 0 |
| − | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | 28 23 1 0 0 0 0 | + | 28 23 1 0 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 |
| − | 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 |
| − | 25 33 1 0 0 0 0 | + | 25 33 1 0 0 0 0 |
| − | 13 26 1 0 0 0 0 | + | 13 26 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FBCCS0001 | + | ID FL3FBCCS0001 |
| − | KNApSAcK_ID C00014017 | + | KNApSAcK_ID C00014017 |
| − | NAME Parkinsonin A;8-D-Glucopyranosyl-7,3',4'-trihydroxy-5-methoxyflavone;2-(3,4-Dihydroxyphenyl)-8-beta-D-glucopyranosyl-7-hydroxy-5-methoxy-4H-1-benzopyran-4-one | + | NAME Parkinsonin A;8-D-Glucopyranosyl-7,3',4'-trihydroxy-5-methoxyflavone;2-(3,4-Dihydroxyphenyl)-8-beta-D-glucopyranosyl-7-hydroxy-5-methoxy-4H-1-benzopyran-4-one |
| − | CAS_RN 6980-21-8 | + | CAS_RN 6980-21-8 |
| − | FORMULA C22H22O11 | + | FORMULA C22H22O11 |
| − | EXACTMASS 462.116211546 | + | EXACTMASS 462.116211546 |
| − | AVERAGEMASS 462.40348000000006 | + | AVERAGEMASS 462.40348000000006 |
| − | SMILES c(c1)(c(ccc1C(=C4)Oc(c3C(=O)4)c(c(cc3OC)O)C(O2)C(O)C(C(C2CO)O)O)O)O | + | SMILES c(c1)(c(ccc1C(=C4)Oc(c3C(=O)4)c(c(cc3OC)O)C(O2)C(O)C(C(C2CO)O)O)O)O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
33 36 0 0 0 0 0 0 0 0999 V2000
1.0537 0.5662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0537 -0.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7682 -0.6713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4827 -0.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4827 0.5662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7682 0.9787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3000 -0.6939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4144 -0.2814 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1289 -0.6939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1289 -1.5189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4144 -1.9314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3000 -1.5189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8434 -0.2814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5578 -0.6939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5578 -1.5189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8434 -1.9314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2289 -0.3065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8434 -2.6709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4144 -2.5035 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0941 0.9192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2289 -0.6896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5338 -3.0696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7777 2.6252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4583 2.1585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1879 1.3787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3526 0.5701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6720 1.0368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9423 1.8166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3704 2.0185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1313 2.5183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2969 3.0696 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2348 2.6259 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8392 1.5001 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 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
4 21 1 0 0 0 0
18 22 1 0 0 0 0
23 24 1 1 0 0 0
24 25 1 1 0 0 0
26 25 1 1 0 0 0
26 27 1 0 0 0 0
27 28 1 0 0 0 0
28 23 1 0 0 0 0
28 29 1 0 0 0 0
29 30 1 0 0 0 0
23 31 1 0 0 0 0
24 32 1 0 0 0 0
25 33 1 0 0 0 0
13 26 1 0 0 0 0
S SKP 8
ID FL3FBCCS0001
KNApSAcK_ID C00014017
NAME Parkinsonin A;8-D-Glucopyranosyl-7,3',4'-trihydroxy-5-methoxyflavone;2-(3,4-Dihydroxyphenyl)-8-beta-D-glucopyranosyl-7-hydroxy-5-methoxy-4H-1-benzopyran-4-one
CAS_RN 6980-21-8
FORMULA C22H22O11
EXACTMASS 462.116211546
AVERAGEMASS 462.40348000000006
SMILES c(c1)(c(ccc1C(=C4)Oc(c3C(=O)4)c(c(cc3OC)O)C(O2)C(O)C(C(C2CO)O)O)O)O
M END
