Mol:FL2FACNP0010
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 31 35 0 0 0 0 0 0 0 0999 V2000 | + | 31 35 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.1082 0.6418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1082 0.6418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0896 -0.1620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0896 -0.1620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3125 -0.5472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3125 -0.5472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6576 -0.1461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6576 -0.1461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6434 0.6787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6434 0.6787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3691 1.1038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3691 1.1038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0973 -0.5716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0973 -0.5716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7711 -0.1707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7711 -0.1707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7619 0.6957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7619 0.6957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0780 1.0789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0780 1.0789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4764 1.1082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4764 1.1082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1675 0.7217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1675 0.7217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8749 1.1135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8749 1.1135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9038 1.9370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9038 1.9370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1875 2.3747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1875 2.3747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4672 1.9746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4672 1.9746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0973 -1.3134 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0973 -1.3134 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4761 2.2674 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4761 2.2674 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4796 0.7643 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4796 0.7643 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3738 1.9543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3738 1.9543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1693 2.3839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1693 2.3839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9083 1.9219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9083 1.9219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8918 1.0303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8918 1.0303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.4431 2.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4431 2.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.4796 1.5921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4796 1.5921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8118 -0.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8118 -0.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8093 -1.4777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8093 -1.4777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0503 -1.8407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0503 -1.8407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3078 -1.4612 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3078 -1.4612 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7367 -2.3839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7367 -2.3839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5786 -2.3690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5786 -2.3690 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 |
| − | 14 18 1 0 0 0 0 | + | 14 18 1 0 0 0 0 |
| − | 13 19 1 0 0 0 0 | + | 13 19 1 0 0 0 0 |
| − | 6 20 1 0 0 0 0 | + | 6 20 1 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | 23 1 1 0 0 0 0 | + | 23 1 1 0 0 0 0 |
| − | 22 24 1 0 0 0 0 | + | 22 24 1 0 0 0 0 |
| − | 22 25 1 0 0 0 0 | + | 22 25 1 0 0 0 0 |
| − | 2 26 1 0 0 0 0 | + | 2 26 1 0 0 0 0 |
| − | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | 28 29 1 0 0 0 0 | + | 28 29 1 0 0 0 0 |
| − | 29 3 1 0 0 0 0 | + | 29 3 1 0 0 0 0 |
| − | 28 30 1 0 0 0 0 | + | 28 30 1 0 0 0 0 |
| − | 28 31 1 0 0 0 0 | + | 28 31 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FACNP0010 | + | ID FL2FACNP0010 |
| − | KNApSAcK_ID C00014253 | + | KNApSAcK_ID C00014253 |
| − | NAME Dorsmanin E;3',4'-Dihydroxy-bis(6'',6''-dimethyldihydropyrano[2'',3'':5,6][2'',3'':7,8])flavanone | + | NAME Dorsmanin E;3',4'-Dihydroxy-bis(6'',6''-dimethyldihydropyrano[2'',3'':5,6][2'',3'':7,8])flavanone |
| − | CAS_RN 234429-61-9 | + | CAS_RN 234429-61-9 |
| − | FORMULA C25H28O6 | + | FORMULA C25H28O6 |
| − | EXACTMASS 424.188588628 | + | EXACTMASS 424.188588628 |
| − | AVERAGEMASS 424.48622 | + | AVERAGEMASS 424.48622 |
| − | SMILES O(c31)C(c(c5)cc(c(c5)O)O)CC(=O)c1c(O4)c(CCC(C)(C)4)c(c23)OC(CC2)(C)C | + | SMILES O(c31)C(c(c5)cc(c(c5)O)O)CC(=O)c1c(O4)c(CCC(C)(C)4)c(c23)OC(CC2)(C)C |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
31 35 0 0 0 0 0 0 0 0999 V2000
-2.1082 0.6418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0896 -0.1620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3125 -0.5472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6576 -0.1461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6434 0.6787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3691 1.1038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0973 -0.5716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7711 -0.1707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7619 0.6957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0780 1.0789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4764 1.1082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1675 0.7217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8749 1.1135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9038 1.9370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1875 2.3747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4672 1.9746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0973 -1.3134 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4761 2.2674 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4796 0.7643 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3738 1.9543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1693 2.3839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9083 1.9219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8918 1.0303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.4431 2.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4796 1.5921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8118 -0.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8093 -1.4777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0503 -1.8407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3078 -1.4612 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7367 -2.3839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5786 -2.3690 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
14 18 1 0 0 0 0
13 19 1 0 0 0 0
6 20 1 0 0 0 0
20 21 1 0 0 0 0
21 22 1 0 0 0 0
22 23 1 0 0 0 0
23 1 1 0 0 0 0
22 24 1 0 0 0 0
22 25 1 0 0 0 0
2 26 1 0 0 0 0
26 27 1 0 0 0 0
27 28 1 0 0 0 0
28 29 1 0 0 0 0
29 3 1 0 0 0 0
28 30 1 0 0 0 0
28 31 1 0 0 0 0
S SKP 8
ID FL2FACNP0010
KNApSAcK_ID C00014253
NAME Dorsmanin E;3',4'-Dihydroxy-bis(6'',6''-dimethyldihydropyrano[2'',3'':5,6][2'',3'':7,8])flavanone
CAS_RN 234429-61-9
FORMULA C25H28O6
EXACTMASS 424.188588628
AVERAGEMASS 424.48622
SMILES O(c31)C(c(c5)cc(c(c5)O)O)CC(=O)c1c(O4)c(CCC(C)(C)4)c(c23)OC(CC2)(C)C
M END
