Mol:FL2F1ANP0008
From Metabolomics.JP
(Difference between revisions)
| Line 1: | Line 1: | ||
| − | + | ||
| − | + | ||
| − | 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 |
| − | -2.2323 0.1191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2323 0.1191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2137 -0.6847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2137 -0.6847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4366 -1.0700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4366 -1.0700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7817 -0.6689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7817 -0.6689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7676 0.1560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7676 0.1560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4932 0.5810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4932 0.5810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0268 -1.0944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0268 -1.0944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6470 -0.6934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6470 -0.6934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6378 0.1729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6378 0.1729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0461 0.5562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0461 0.5562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3522 0.5854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3522 0.5854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0433 0.1990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0433 0.1990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7547 0.5975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7547 0.5975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7752 1.4222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7752 1.4222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0634 1.8520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0634 1.8520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3430 1.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3430 1.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0268 -1.8361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0268 -1.8361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0160 0.4911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0160 0.4911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9303 -1.0985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9303 -1.0985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6098 -0.7061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6098 -0.7061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.2972 -1.1030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.2972 -1.1030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.2972 -1.8520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.2972 -1.8520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.8574 -0.7796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.8574 -0.7796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4587 0.1673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4587 0.1673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.1832 0.5620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1832 0.5620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.2037 1.3868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.2037 1.3868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4997 1.8169 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4997 1.8169 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.8329 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.8329 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.8574 1.0093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.8574 1.0093 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 |
| − | 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 6 0 0 0 | + | 9 11 1 6 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 |
| − | 18 1 1 0 0 0 0 | + | 18 1 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 |
| − | 13 24 1 0 0 0 0 | + | 13 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 14 1 0 0 0 0 | + | 27 14 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 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2F1ANP0008 | + | ID FL2F1ANP0008 |
| − | KNApSAcK_ID C00014226 | + | KNApSAcK_ID C00014226 |
| − | NAME Dinklagin A;7-Hydroxy-6-prenyl-6'',6''-dimethylpyrano[2'',3'':4',3']flavanone | + | NAME Dinklagin A;7-Hydroxy-6-prenyl-6'',6''-dimethylpyrano[2'',3'':4',3']flavanone |
| − | CAS_RN 487010-46-8 | + | CAS_RN 487010-46-8 |
| − | FORMULA C25H26O4 | + | FORMULA C25H26O4 |
| − | EXACTMASS 390.18310931999997 | + | EXACTMASS 390.18310931999997 |
| − | AVERAGEMASS 390.47153999999995 | + | AVERAGEMASS 390.47153999999995 |
| − | SMILES c(c4)(CC=C(C)C)c(cc(c43)OC(CC3=O)c(c1)cc(C=2)c(OC(C2)(C)C)c1)O | + | SMILES c(c4)(CC=C(C)C)c(cc(c43)OC(CC3=O)c(c1)cc(C=2)c(OC(C2)(C)C)c1)O |
M END | M END | ||
| − | |||
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
-2.2323 0.1191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2137 -0.6847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4366 -1.0700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7817 -0.6689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7676 0.1560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4932 0.5810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0268 -1.0944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6470 -0.6934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6378 0.1729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0461 0.5562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3522 0.5854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0433 0.1990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7547 0.5975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7752 1.4222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0634 1.8520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3430 1.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0268 -1.8361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0160 0.4911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.9303 -1.0985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6098 -0.7061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2972 -1.1030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2972 -1.8520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.8574 -0.7796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4587 0.1673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1832 0.5620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2037 1.3868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4997 1.8169 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.8329 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8574 1.0093 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
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 6 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
18 1 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
13 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 14 1 0 0 0 0
26 28 1 0 0 0 0
26 29 1 0 0 0 0
S SKP 8
ID FL2F1ANP0008
KNApSAcK_ID C00014226
NAME Dinklagin A;7-Hydroxy-6-prenyl-6'',6''-dimethylpyrano[2'',3'':4',3']flavanone
CAS_RN 487010-46-8
FORMULA C25H26O4
EXACTMASS 390.18310931999997
AVERAGEMASS 390.47153999999995
SMILES c(c4)(CC=C(C)C)c(cc(c43)OC(CC3=O)c(c1)cc(C=2)c(OC(C2)(C)C)c1)O
M END
