Mol:FLIAALNP0018
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 34 38 0 0 0 0 0 0 0 0999 V2000 | + | 34 38 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.4077 0.5318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4077 0.5318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4077 -0.1106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4077 -0.1106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8514 -0.4318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8514 -0.4318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2951 -0.1106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2951 -0.1106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2951 0.5318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2951 0.5318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8514 0.8530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8514 0.8530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2612 -0.4318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2612 -0.4318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8175 -0.1106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8175 -0.1106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8175 0.5318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8175 0.5318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2612 0.8530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2612 0.8530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3736 -0.4316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3736 -0.4316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3736 -1.1184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3736 -1.1184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9684 -1.4618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9684 -1.4618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5632 -1.1184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5632 -1.1184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5632 -0.4316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5632 -0.4316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9684 -0.0882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9684 -0.0882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2612 -1.0771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2612 -1.0771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8514 -1.0739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8514 -1.0739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9638 -0.4316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9638 -0.4316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9638 -1.0724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9638 -1.0724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5187 -1.3928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5187 -1.3928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5187 -2.0335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5187 -2.0335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0736 -1.0724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0736 -1.0724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8514 1.4953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8514 1.4953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4077 1.8165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4077 1.8165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9640 1.4953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9640 1.4953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9640 0.8530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9640 0.8530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9640 2.2054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9640 2.2054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5105 1.1798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5105 1.1798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1112 -2.1336 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1112 -2.1336 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7942 -2.2054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7942 -2.2054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0736 -1.5780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0736 -1.5780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2655 0.4958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2655 0.4958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9800 0.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9800 0.0833 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 |
| − | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
| − | 2 19 1 0 0 0 0 | + | 2 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 |
| − | 6 24 1 0 0 0 0 | + | 6 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 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
| − | 27 1 1 0 0 0 0 | + | 27 1 1 0 0 0 0 |
| − | 26 28 1 0 0 0 0 | + | 26 28 1 0 0 0 0 |
| − | 26 29 1 0 0 0 0 | + | 26 29 1 0 0 0 0 |
| − | 13 30 1 0 0 0 0 | + | 13 30 1 0 0 0 0 |
| − | 30 31 1 0 0 0 0 | + | 30 31 1 0 0 0 0 |
| − | 31 32 1 0 0 0 0 | + | 31 32 1 0 0 0 0 |
| − | 32 14 1 0 0 0 0 | + | 32 14 1 0 0 0 0 |
| − | 16 33 1 0 0 0 0 | + | 16 33 1 0 0 0 0 |
| − | 33 34 1 0 0 0 0 | + | 33 34 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 33 34 | + | M SAL 1 2 33 34 |
| − | M SBL 1 1 37 | + | M SBL 1 1 37 |
| − | M SMT 1 OCH3 | + | M SMT 1 OCH3 |
| − | M SBV 1 37 -4.4683 5.3027 | + | M SBV 1 37 -4.4683 5.3027 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FLIAALNP0018 | + | ID FLIAALNP0018 |
| − | KNApSAcK_ID C00009947 | + | KNApSAcK_ID C00009947 |
| − | NAME Euchrenone b3;5-Hydroxy-2'-methoxy-4',5'-methylenedioxy-6-prenyl-6'',6''-dimethylpyrano[2'',3'':7,8]isoflavone | + | NAME Euchrenone b3;5-Hydroxy-2'-methoxy-4',5'-methylenedioxy-6-prenyl-6'',6''-dimethylpyrano[2'',3'':7,8]isoflavone |
| − | CAS_RN 119061-11-9 | + | CAS_RN 119061-11-9 |
| − | FORMULA C27H26O7 | + | FORMULA C27H26O7 |
| − | EXACTMASS 462.167853186 | + | EXACTMASS 462.167853186 |
| − | AVERAGEMASS 462.49114 | + | AVERAGEMASS 462.49114 |
| − | SMILES C(=C3c(c(OC)5)cc(c4c5)OCO4)Oc(c12)c(C3=O)c(O)c(c(OC(C)(C)C=C2)1)CC=C(C)C | + | SMILES C(=C3c(c(OC)5)cc(c4c5)OCO4)Oc(c12)c(C3=O)c(O)c(c(OC(C)(C)C=C2)1)CC=C(C)C |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
34 38 0 0 0 0 0 0 0 0999 V2000
-1.4077 0.5318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4077 -0.1106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8514 -0.4318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2951 -0.1106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2951 0.5318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8514 0.8530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2612 -0.4318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8175 -0.1106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8175 0.5318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2612 0.8530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3736 -0.4316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3736 -1.1184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9684 -1.4618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5632 -1.1184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5632 -0.4316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9684 -0.0882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2612 -1.0771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8514 -1.0739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9638 -0.4316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9638 -1.0724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5187 -1.3928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5187 -2.0335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0736 -1.0724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8514 1.4953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4077 1.8165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9640 1.4953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9640 0.8530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9640 2.2054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5105 1.1798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1112 -2.1336 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7942 -2.2054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0736 -1.5780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2655 0.4958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9800 0.0833 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
3 18 1 0 0 0 0
2 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
6 24 1 0 0 0 0
24 25 2 0 0 0 0
25 26 1 0 0 0 0
26 27 1 0 0 0 0
27 1 1 0 0 0 0
26 28 1 0 0 0 0
26 29 1 0 0 0 0
13 30 1 0 0 0 0
30 31 1 0 0 0 0
31 32 1 0 0 0 0
32 14 1 0 0 0 0
16 33 1 0 0 0 0
33 34 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 33 34
M SBL 1 1 37
M SMT 1 OCH3
M SBV 1 37 -4.4683 5.3027
S SKP 8
ID FLIAALNP0018
KNApSAcK_ID C00009947
NAME Euchrenone b3;5-Hydroxy-2'-methoxy-4',5'-methylenedioxy-6-prenyl-6'',6''-dimethylpyrano[2'',3'':7,8]isoflavone
CAS_RN 119061-11-9
FORMULA C27H26O7
EXACTMASS 462.167853186
AVERAGEMASS 462.49114
SMILES C(=C3c(c(OC)5)cc(c4c5)OCO4)Oc(c12)c(C3=O)c(O)c(c(OC(C)(C)C=C2)1)CC=C(C)C
M END
