Mol:FL1C1ANI0012
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 30 0 0 0 0 0 0 0 0999 V2000 | + | 29 30 0 0 0 0 0 0 0 0999 V2000 |
| − | 2.0085 -0.3162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0085 -0.3162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0085 -0.9586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0085 -0.9586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5648 -1.2797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5648 -1.2797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1211 -0.9586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1211 -0.9586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1211 -0.3162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1211 -0.3162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5648 0.0050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5648 0.0050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7515 -0.9586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7515 -0.9586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3078 -1.2797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3078 -1.2797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1954 -1.2796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1954 -1.2796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3656 -0.9460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3656 -0.9460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1954 -1.9204 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1954 -1.9204 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3656 -0.3079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3656 -0.3079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9182 0.0112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9182 0.0112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4708 -0.3079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4708 -0.3079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4708 -0.9460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4708 -0.9460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9182 -1.2651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9182 -1.2651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6774 0.0050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6774 0.0050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9182 -1.9032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9182 -1.9032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0234 0.0111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0234 0.0111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0234 -1.2650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0234 -1.2650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5747 -0.9467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5747 -0.9467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1260 -1.2650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1260 -1.2650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6774 -0.9467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6774 -0.9467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1260 -1.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1260 -1.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9182 0.6492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9182 0.6492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4695 0.9675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4695 0.9675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4695 1.6027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4695 1.6027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0197 1.9204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0197 1.9204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9194 1.9204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9194 1.9204 0.0000 C 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 |
| − | 7 8 2 0 0 0 0 | + | 7 8 2 0 0 0 0 |
| − | 7 9 1 0 0 0 0 | + | 7 9 1 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 9 11 2 0 0 0 0 | + | 9 11 2 0 0 0 0 |
| − | 2 8 1 0 0 0 0 | + | 2 8 1 0 0 0 0 |
| − | 10 12 2 0 0 0 0 | + | 10 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 10 1 0 0 0 0 | + | 16 10 1 0 0 0 0 |
| − | 17 5 1 0 0 0 0 | + | 17 5 1 0 0 0 0 |
| − | 18 16 1 0 0 0 0 | + | 18 16 1 0 0 0 0 |
| − | 14 19 1 0 0 0 0 | + | 14 19 1 0 0 0 0 |
| − | 15 20 1 0 0 0 0 | + | 15 20 1 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 21 22 2 0 0 0 0 | + | 21 22 2 0 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | 22 24 1 0 0 0 0 | + | 22 24 1 0 0 0 0 |
| − | 13 25 1 0 0 0 0 | + | 13 25 1 0 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 26 27 2 0 0 0 0 | + | 26 27 2 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | 27 29 1 0 0 0 0 | + | 27 29 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL1C1ANI0012 | + | ID FL1C1ANI0012 |
| − | KNApSAcK_ID C00007073 | + | KNApSAcK_ID C00007073 |
| − | NAME 4,2',4'-Trihydroxy-3',5'-diprenylchalcone | + | NAME 4,2',4'-Trihydroxy-3',5'-diprenylchalcone |
| − | CAS_RN 63529-05-5 | + | CAS_RN 63529-05-5 |
| − | FORMULA C25H28O4 | + | FORMULA C25H28O4 |
| − | EXACTMASS 392.19875938399997 | + | EXACTMASS 392.19875938399997 |
| − | AVERAGEMASS 392.48742 | + | AVERAGEMASS 392.48742 |
| − | SMILES C(C)(C)=CCc(c1O)c(c(CC=C(C)C)cc1C(C=Cc(c2)ccc(O)c2)=O)O | + | SMILES C(C)(C)=CCc(c1O)c(c(CC=C(C)C)cc1C(C=Cc(c2)ccc(O)c2)=O)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/
29 30 0 0 0 0 0 0 0 0999 V2000
2.0085 -0.3162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0085 -0.9586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5648 -1.2797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1211 -0.9586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1211 -0.3162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5648 0.0050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7515 -0.9586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3078 -1.2797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1954 -1.2796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3656 -0.9460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1954 -1.9204 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3656 -0.3079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9182 0.0112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4708 -0.3079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4708 -0.9460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9182 -1.2651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6774 0.0050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9182 -1.9032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0234 0.0111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0234 -1.2650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5747 -0.9467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1260 -1.2650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6774 -0.9467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1260 -1.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9182 0.6492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4695 0.9675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4695 1.6027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0197 1.9204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9194 1.9204 0.0000 C 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
7 8 2 0 0 0 0
7 9 1 0 0 0 0
9 10 1 0 0 0 0
9 11 2 0 0 0 0
2 8 1 0 0 0 0
10 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 10 1 0 0 0 0
17 5 1 0 0 0 0
18 16 1 0 0 0 0
14 19 1 0 0 0 0
15 20 1 0 0 0 0
20 21 1 0 0 0 0
21 22 2 0 0 0 0
22 23 1 0 0 0 0
22 24 1 0 0 0 0
13 25 1 0 0 0 0
25 26 1 0 0 0 0
26 27 2 0 0 0 0
27 28 1 0 0 0 0
27 29 1 0 0 0 0
S SKP 8
ID FL1C1ANI0012
KNApSAcK_ID C00007073
NAME 4,2',4'-Trihydroxy-3',5'-diprenylchalcone
CAS_RN 63529-05-5
FORMULA C25H28O4
EXACTMASS 392.19875938399997
AVERAGEMASS 392.48742
SMILES C(C)(C)=CCc(c1O)c(c(CC=C(C)C)cc1C(C=Cc(c2)ccc(O)c2)=O)O
M END
