Mol:FL2FCCNF0002
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 29 32 0 0 0 0 0 0 0 0999 V2000 | + | 29 32 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.2190 -0.2887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2190 -0.2887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2004 -1.0925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2004 -1.0925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4233 -1.4778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4233 -1.4778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7684 -1.0767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7684 -1.0767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7542 -0.2518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7542 -0.2518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4799 0.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4799 0.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0135 -1.5022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0135 -1.5022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6603 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6603 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6511 -0.2349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6511 -0.2349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0328 0.1484 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0328 0.1484 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3656 0.1776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3656 0.1776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0567 -0.2088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0567 -0.2088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7680 0.1897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7680 0.1897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7885 1.0144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7885 1.0144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0767 1.4442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0767 1.4442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3564 1.0440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3564 1.0440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0135 -2.2439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0135 -2.2439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3617 1.3454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3617 1.3454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4799 0.9909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4799 0.9909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7654 1.4034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7654 1.4034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7654 2.1304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7654 2.1304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3584 2.4728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3584 2.4728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1580 2.4810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1580 2.4810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8069 -1.7126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8069 -1.7126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4046 -2.4810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4046 -2.4810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5495 -2.3359 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5495 -2.3359 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8564 0.0793 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8564 0.0793 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3879 -0.2275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3879 -0.2275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3879 -0.1682 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3879 -0.1682 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 2 3 2 0 0 0 0 | + | 2 3 2 0 0 0 0 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 4 5 2 0 0 0 0 | + | 4 5 2 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 6 1 2 0 0 0 0 | + | 6 1 2 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 1 0 0 0 0 | + | 8 9 1 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 |
| − | 14 18 1 0 0 0 0 | + | 14 18 1 0 0 0 0 |
| − | 6 19 1 0 0 0 0 | + | 6 19 1 0 0 0 0 |
| − | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
| − | 20 21 2 0 0 0 0 | + | 20 21 2 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 21 23 1 0 0 0 0 | + | 21 23 1 0 0 0 0 |
| − | 2 24 1 0 0 0 0 | + | 2 24 1 0 0 0 0 |
| − | 24 25 2 0 0 0 0 | + | 24 25 2 0 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 26 3 1 0 0 0 0 | + | 26 3 1 0 0 0 0 |
| − | 1 27 1 0 0 0 0 | + | 1 27 1 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | 13 29 1 0 0 0 0 | + | 13 29 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FCCNF0002 | + | ID FL2FCCNF0002 |
| − | KNApSAcK_ID C00014223 | + | KNApSAcK_ID C00014223 |
| − | NAME 3',4'-Dihydroxy-7-methoxy-8-prenyl-5''-(2-hydroxyisopropyl)-[2'',3'':5,6]furanoflavanone | + | NAME 3',4'-Dihydroxy-7-methoxy-8-prenyl-5''-(2-hydroxyisopropyl)-[2'',3'':5,6]furanoflavanone |
| − | CAS_RN 325149-80-2 | + | CAS_RN 325149-80-2 |
| − | FORMULA C23H22O6 | + | FORMULA C23H22O6 |
| − | EXACTMASS 394.141638436 | + | EXACTMASS 394.141638436 |
| − | AVERAGEMASS 394.41718000000003 | + | AVERAGEMASS 394.41718000000003 |
| − | SMILES C(C)(C)=CCc(c(OC)1)c(O3)c(C(=O)CC3c(c4)ccc(c4O)O)c(o2)c(cc2)1 | + | SMILES C(C)(C)=CCc(c(OC)1)c(O3)c(C(=O)CC3c(c4)ccc(c4O)O)c(o2)c(cc2)1 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
29 32 0 0 0 0 0 0 0 0999 V2000
-2.2190 -0.2887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2004 -1.0925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4233 -1.4778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7684 -1.0767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7542 -0.2518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4799 0.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0135 -1.5022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6603 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6511 -0.2349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0328 0.1484 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3656 0.1776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0567 -0.2088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7680 0.1897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7885 1.0144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0767 1.4442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3564 1.0440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0135 -2.2439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3617 1.3454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4799 0.9909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7654 1.4034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7654 2.1304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3584 2.4728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1580 2.4810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8069 -1.7126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4046 -2.4810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5495 -2.3359 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8564 0.0793 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.3879 -0.2275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3879 -0.1682 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 2 0 0 0 0
3 4 1 0 0 0 0
4 5 2 0 0 0 0
5 6 1 0 0 0 0
6 1 2 0 0 0 0
4 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 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
14 18 1 0 0 0 0
6 19 1 0 0 0 0
19 20 1 0 0 0 0
20 21 2 0 0 0 0
21 22 1 0 0 0 0
21 23 1 0 0 0 0
2 24 1 0 0 0 0
24 25 2 0 0 0 0
25 26 1 0 0 0 0
26 3 1 0 0 0 0
1 27 1 0 0 0 0
27 28 1 0 0 0 0
13 29 1 0 0 0 0
S SKP 8
ID FL2FCCNF0002
KNApSAcK_ID C00014223
NAME 3',4'-Dihydroxy-7-methoxy-8-prenyl-5''-(2-hydroxyisopropyl)-[2'',3'':5,6]furanoflavanone
CAS_RN 325149-80-2
FORMULA C23H22O6
EXACTMASS 394.141638436
AVERAGEMASS 394.41718000000003
SMILES C(C)(C)=CCc(c(OC)1)c(O3)c(C(=O)CC3c(c4)ccc(c4O)O)c(o2)c(cc2)1
M END
