Mol:FL2FABNI0002
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 26 28 0 0 0 0 0 0 0 0999 V2000 | + | 26 28 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.1998 -0.9706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1998 -0.9706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6790 -1.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6790 -1.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1581 -0.9706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1581 -0.9706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1581 -0.3692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1581 -0.3692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6790 -0.0684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6790 -0.0684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1998 -0.3692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1998 -0.3692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6372 -1.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6372 -1.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1163 -0.9706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1163 -0.9706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1163 -0.3692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1163 -0.3692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6372 -0.0684 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6372 -0.0684 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4041 -0.0687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4041 -0.0687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6372 -1.7953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6372 -1.7953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9384 -0.3772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9384 -0.3772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4728 -0.0687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4728 -0.0687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4728 0.5483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4728 0.5483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9384 0.8568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9384 0.8568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4041 0.5483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4041 0.5483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7207 -0.0684 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7207 -0.0684 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6603 0.5859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6603 0.5859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1787 0.8733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1787 0.8733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1787 1.4879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1787 1.4879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7110 1.7953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7110 1.7953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6464 1.7953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6464 1.7953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6790 -1.7249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6790 -1.7249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0063 0.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0063 0.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7207 0.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7207 0.4438 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 |
| − | 3 7 1 0 0 0 0 | + | 3 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 4 1 0 0 0 0 | + | 10 4 1 0 0 0 0 |
| − | 9 11 1 0 0 0 0 | + | 9 11 1 0 0 0 0 |
| − | 7 12 2 0 0 0 0 | + | 7 12 2 0 0 0 0 |
| − | 11 13 2 0 0 0 0 | + | 11 13 2 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | 14 15 2 0 0 0 0 | + | 14 15 2 0 0 0 0 |
| − | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
| − | 16 17 2 0 0 0 0 | + | 16 17 2 0 0 0 0 |
| − | 17 11 1 0 0 0 0 | + | 17 11 1 0 0 0 0 |
| − | 6 18 1 0 0 0 0 | + | 6 18 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 |
| − | 19 5 1 0 0 0 0 | + | 19 5 1 0 0 0 0 |
| − | 2 24 1 0 0 0 0 | + | 2 24 1 0 0 0 0 |
| − | 15 25 1 0 0 0 0 | + | 15 25 1 0 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | M STY 1 1 SUP | + | M STY 1 1 SUP |
| − | M SLB 1 1 1 | + | M SLB 1 1 1 |
| − | M SAL 1 2 25 26 | + | M SAL 1 2 25 26 |
| − | M SBL 1 1 27 | + | M SBL 1 1 27 |
| − | M SMT 1 OCH3 | + | M SMT 1 OCH3 |
| − | M SBV 1 27 -4.8649 4.3088 | + | M SBV 1 27 -4.8649 4.3088 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FABNI0002 | + | ID FL2FABNI0002 |
| − | KNApSAcK_ID C00008453 | + | KNApSAcK_ID C00008453 |
| − | NAME 5,7-Dihydroxy-4'-methoxy-8-C-prenylflavanone | + | NAME 5,7-Dihydroxy-4'-methoxy-8-C-prenylflavanone |
| − | CAS_RN 120727-36-8 | + | CAS_RN 120727-36-8 |
| − | FORMULA C21H22O5 | + | FORMULA C21H22O5 |
| − | EXACTMASS 354.146723814 | + | EXACTMASS 354.146723814 |
| − | AVERAGEMASS 354.39638 | + | AVERAGEMASS 354.39638 |
| − | SMILES C(=O)(C2)c(c1OC2c(c3)ccc(OC)c3)c(cc(O)c(CC=C(C)C)1)O | + | SMILES C(=O)(C2)c(c1OC2c(c3)ccc(OC)c3)c(cc(O)c(CC=C(C)C)1)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/
26 28 0 0 0 0 0 0 0 0999 V2000
-2.1998 -0.9706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6790 -1.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1581 -0.9706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1581 -0.3692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6790 -0.0684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1998 -0.3692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6372 -1.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1163 -0.9706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1163 -0.3692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6372 -0.0684 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4041 -0.0687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6372 -1.7953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9384 -0.3772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4728 -0.0687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4728 0.5483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9384 0.8568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4041 0.5483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7207 -0.0684 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6603 0.5859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1787 0.8733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1787 1.4879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7110 1.7953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6464 1.7953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6790 -1.7249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0063 0.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7207 0.4438 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
3 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 4 1 0 0 0 0
9 11 1 0 0 0 0
7 12 2 0 0 0 0
11 13 2 0 0 0 0
13 14 1 0 0 0 0
14 15 2 0 0 0 0
15 16 1 0 0 0 0
16 17 2 0 0 0 0
17 11 1 0 0 0 0
6 18 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
19 5 1 0 0 0 0
2 24 1 0 0 0 0
15 25 1 0 0 0 0
25 26 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 25 26
M SBL 1 1 27
M SMT 1 OCH3
M SBV 1 27 -4.8649 4.3088
S SKP 8
ID FL2FABNI0002
KNApSAcK_ID C00008453
NAME 5,7-Dihydroxy-4'-methoxy-8-C-prenylflavanone
CAS_RN 120727-36-8
FORMULA C21H22O5
EXACTMASS 354.146723814
AVERAGEMASS 354.39638
SMILES C(=O)(C2)c(c1OC2c(c3)ccc(OC)c3)c(cc(O)c(CC=C(C)C)1)O
M END
