Mol:FLIA1ANI0005
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 30 32 0 0 0 0 0 0 0 0999 V2000 | + | 30 32 0 0 0 0 0 0 0 0999 V2000 |
| − | -0.0105 0.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0105 0.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0105 0.3315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0105 0.3315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5458 0.0104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5458 0.0104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1021 0.3315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1021 0.3315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1021 0.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1021 0.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5458 1.2951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5458 1.2951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6584 0.0104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6584 0.0104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2147 0.3315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2147 0.3315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2147 0.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2147 0.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6584 1.2951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6584 1.2951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7708 0.0105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7708 0.0105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7708 -0.6763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7708 -0.6763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3656 -1.0197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3656 -1.0197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9604 -0.6763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9604 -0.6763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9604 0.0105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9604 0.0105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3656 0.3539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3656 0.3539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6584 -0.6318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6584 -0.6318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5666 1.2950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5666 1.2950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1120 0.9801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1120 0.9801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6574 1.2949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6574 1.2949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2016 0.9807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2016 0.9807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2016 0.3537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2016 0.3537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7446 1.2942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7446 1.2942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2876 0.9807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2876 0.9807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.8294 1.2936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8294 1.2936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.3712 0.9807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.3712 0.9807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.3712 0.3565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.3712 0.3565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.9118 1.2929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.9118 1.2929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.8264 -1.1763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.8264 -1.1763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.6925 -1.6763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.6925 -1.6763 0.0000 C 0 0 0 0 0 0 0 0 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 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 |
| − | 8 11 1 0 0 0 0 | + | 8 11 1 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 12 13 2 0 0 0 0 | + | 12 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 11 2 0 0 0 0 | + | 16 11 2 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 7 17 2 0 0 0 0 | + | 7 17 2 0 0 0 0 |
| − | 1 18 1 0 0 0 0 | + | 1 18 1 0 0 0 0 |
| − | 18 19 1 0 0 0 0 | + | 18 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 |
| − | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 25 26 2 0 0 0 0 | + | 25 26 2 0 0 0 0 |
| − | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
| − | 26 28 1 0 0 0 0 | + | 26 28 1 0 0 0 0 |
| − | 14 29 1 0 0 0 0 | + | 14 29 1 0 0 0 0 |
| − | 29 30 1 0 0 0 0 | + | 29 30 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 29 30 | + | M SAL 1 2 29 30 |
| − | M SBL 1 1 31 | + | M SBL 1 1 31 |
| − | M SMT 1 OCH3 | + | M SMT 1 OCH3 |
| − | M SVB 1 31 4.1973 -0.8826 | + | M SVB 1 31 4.1973 -0.8826 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FLIA1ANI0005 | + | ID FLIA1ANI0005 |
| − | KNApSAcK_ID C00009844 | + | KNApSAcK_ID C00009844 |
| − | NAME 7-Geranylformononetin;4'-Methoxy-7-geranyloxyisoflavone | + | NAME 7-Geranylformononetin;4'-Methoxy-7-geranyloxyisoflavone |
| − | CAS_RN 130289-24-6 | + | CAS_RN 130289-24-6 |
| − | FORMULA C26H28O4 | + | FORMULA C26H28O4 |
| − | EXACTMASS 404.19875938399997 | + | EXACTMASS 404.19875938399997 |
| − | AVERAGEMASS 404.49812 | + | AVERAGEMASS 404.49812 |
| − | SMILES C(CC=C(C)C)C(=CCOc(c1)cc(O2)c(C(=O)C(c(c3)ccc(OC)c3)=C2)c1)C | + | SMILES C(CC=C(C)C)C(=CCOc(c1)cc(O2)c(C(=O)C(c(c3)ccc(OC)c3)=C2)c1)C |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
30 32 0 0 0 0 0 0 0 0999 V2000
-0.0105 0.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0105 0.3315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5458 0.0104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1021 0.3315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1021 0.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5458 1.2951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6584 0.0104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2147 0.3315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2147 0.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6584 1.2951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7708 0.0105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7708 -0.6763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3656 -1.0197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9604 -0.6763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9604 0.0105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3656 0.3539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6584 -0.6318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5666 1.2950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1120 0.9801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6574 1.2949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2016 0.9807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2016 0.3537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7446 1.2942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2876 0.9807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8294 1.2936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3712 0.9807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3712 0.3565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9118 1.2929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8264 -1.1763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.6925 -1.6763 0.0000 C 0 0 0 0 0 0 0 0 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 2 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
8 11 1 0 0 0 0
11 12 1 0 0 0 0
12 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 11 2 0 0 0 0
1 2 1 0 0 0 0
7 17 2 0 0 0 0
1 18 1 0 0 0 0
18 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
23 24 1 0 0 0 0
24 25 1 0 0 0 0
25 26 2 0 0 0 0
26 27 1 0 0 0 0
26 28 1 0 0 0 0
14 29 1 0 0 0 0
29 30 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 29 30
M SBL 1 1 31
M SMT 1 OCH3
M SVB 1 31 4.1973 -0.8826
S SKP 8
ID FLIA1ANI0005
KNApSAcK_ID C00009844
NAME 7-Geranylformononetin;4'-Methoxy-7-geranyloxyisoflavone
CAS_RN 130289-24-6
FORMULA C26H28O4
EXACTMASS 404.19875938399997
AVERAGEMASS 404.49812
SMILES C(CC=C(C)C)C(=CCOc(c1)cc(O2)c(C(=O)C(c(c3)ccc(OC)c3)=C2)c1)C
M END
