Mol:FL3FACGS0083
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 38 41 0 0 0 0 0 0 0 0999 V2000 | + | 38 41 0 0 0 0 0 0 0 0999 V2000 |
| − | 1.5054 0.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5054 0.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5054 0.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5054 0.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2199 -0.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2199 -0.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9344 0.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9344 0.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9344 0.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9344 0.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2199 1.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2199 1.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7909 -0.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7909 -0.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0765 0.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0765 0.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6380 -0.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6380 -0.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6380 -1.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6380 -1.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0765 -1.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0765 -1.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7909 -1.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7909 -1.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3525 0.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3525 0.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0669 -0.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0669 -0.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0669 -1.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0669 -1.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3525 -1.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3525 -1.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0765 -2.2099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0765 -2.2099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7814 0.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7814 0.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3525 -2.1776 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3525 -2.1776 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6399 1.3849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6399 1.3849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5088 -0.1733 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5088 -0.1733 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -5.3003 0.3128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.3003 0.3128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.8878 -0.4016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.8878 -0.4016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.0897 -0.1925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.0897 -0.1925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2965 -0.4194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2965 -0.4194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.7089 0.2952 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.7089 0.2952 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.5071 0.0862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.5071 0.0862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.6640 0.6718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.6640 0.6718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -5.1437 0.9488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.1437 0.9488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -5.7833 -0.1702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.7833 -0.1702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -5.3363 -0.1427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.3363 -0.1427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.2611 -0.8323 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.2611 -0.8323 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.3544 0.9724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.3544 0.9724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.3544 0.1474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.3544 0.1474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.0689 1.3849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.0689 1.3849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.0689 2.2099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.0689 2.2099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.7833 0.9724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.7833 0.9724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.7833 0.1474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.7833 0.1474 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 |
| − | 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 |
| − | 16 19 1 0 0 0 0 | + | 16 19 1 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 |
| − | 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 |
| − | 25 18 1 0 0 0 0 | + | 25 18 1 0 0 0 0 |
| − | 20 33 1 0 0 0 0 | + | 20 33 1 0 0 0 0 |
| − | 33 34 2 0 0 0 0 | + | 33 34 2 0 0 0 0 |
| − | 33 35 1 0 0 0 0 | + | 33 35 1 0 0 0 0 |
| − | 35 36 1 0 0 0 0 | + | 35 36 1 0 0 0 0 |
| − | 35 37 2 0 0 0 0 | + | 35 37 2 0 0 0 0 |
| − | 37 38 1 0 0 0 0 | + | 37 38 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FACGS0083 | + | ID FL3FACGS0083 |
| − | KNApSAcK_ID C00013668 | + | KNApSAcK_ID C00013668 |
| − | NAME Luteolin 7-glucoside-4'-(Z-2-methyl-2-butenoate);7-(beta-D-Glucopyranosyloxy)-5-hydroxy-2-[3-hydroxy-4-[[(2Z)-2-methyl-1-oxo-2-butenyl]oxy]phenyl]-4H-1-benzopyran-4-one | + | NAME Luteolin 7-glucoside-4'-(Z-2-methyl-2-butenoate);7-(beta-D-Glucopyranosyloxy)-5-hydroxy-2-[3-hydroxy-4-[[(2Z)-2-methyl-1-oxo-2-butenyl]oxy]phenyl]-4H-1-benzopyran-4-one |
| − | CAS_RN 457624-79-2 | + | CAS_RN 457624-79-2 |
| − | FORMULA C26H26O12 | + | FORMULA C26H26O12 |
| − | EXACTMASS 530.1424262959999 | + | EXACTMASS 530.1424262959999 |
| − | AVERAGEMASS 530.4774399999999 | + | AVERAGEMASS 530.4774399999999 |
| − | SMILES c(O)(c3)c(c(cc(OC(C(O)4)OC(CO)C(O)C4O)3)1)C(=O)C=C(c(c2)ccc(OC(=O)C(=CC)C)c2O)O1 | + | SMILES c(O)(c3)c(c(cc(OC(C(O)4)OC(CO)C(O)C4O)3)1)C(=O)C=C(c(c2)ccc(OC(=O)C(=CC)C)c2O)O1 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
38 41 0 0 0 0 0 0 0 0999 V2000
1.5054 0.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5054 0.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2199 -0.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9344 0.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9344 0.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2199 1.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7909 -0.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0765 0.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6380 -0.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6380 -1.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0765 -1.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7909 -1.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3525 0.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0669 -0.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0669 -1.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3525 -1.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0765 -2.2099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7814 0.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3525 -2.1776 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6399 1.3849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5088 -0.1733 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.3003 0.3128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.8878 -0.4016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0897 -0.1925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2965 -0.4194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7089 0.2952 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.5071 0.0862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6640 0.6718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1437 0.9488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.7833 -0.1702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.3363 -0.1427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.2611 -0.8323 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.3544 0.9724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3544 0.1474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.0689 1.3849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0689 2.2099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7833 0.9724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7833 0.1474 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 18 1 0 0 0 0
11 17 2 0 0 0 0
16 19 1 0 0 0 0
5 20 1 0 0 0 0
4 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
25 18 1 0 0 0 0
20 33 1 0 0 0 0
33 34 2 0 0 0 0
33 35 1 0 0 0 0
35 36 1 0 0 0 0
35 37 2 0 0 0 0
37 38 1 0 0 0 0
S SKP 8
ID FL3FACGS0083
KNApSAcK_ID C00013668
NAME Luteolin 7-glucoside-4'-(Z-2-methyl-2-butenoate);7-(beta-D-Glucopyranosyloxy)-5-hydroxy-2-[3-hydroxy-4-[[(2Z)-2-methyl-1-oxo-2-butenyl]oxy]phenyl]-4H-1-benzopyran-4-one
CAS_RN 457624-79-2
FORMULA C26H26O12
EXACTMASS 530.1424262959999
AVERAGEMASS 530.4774399999999
SMILES c(O)(c3)c(c(cc(OC(C(O)4)OC(CO)C(O)C4O)3)1)C(=O)C=C(c(c2)ccc(OC(=O)C(=CC)C)c2O)O1
M END
