Mol:FL2FA8NP0003
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 34 0 0 0 0 0 0 0 0999 V2000 | + | 31 34 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.3162 -1.3526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3162 -1.3526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7953 -1.6533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7953 -1.6533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2744 -1.3526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2744 -1.3526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2744 -0.7511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2744 -0.7511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7953 -0.4504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7953 -0.4504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3162 -0.7511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3162 -0.7511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2465 -1.6533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2465 -1.6533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7673 -1.3526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7673 -1.3526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7673 -0.7511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7673 -0.7511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2465 -0.4504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2465 -0.4504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2877 -0.4507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2877 -0.4507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2465 -2.1772 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2465 -2.1772 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8221 -0.7592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8221 -0.7592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3564 -0.4507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3564 -0.4507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3564 0.1664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3564 0.1664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8221 0.4749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8221 0.4749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2877 0.1664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2877 0.1664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7953 -2.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7953 -2.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8371 -0.4504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8371 -0.4504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7953 0.1511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7953 0.1511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3157 0.4515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3157 0.4515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3157 1.0524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3157 1.0524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8361 1.3529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8361 1.3529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8371 0.1511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8371 0.1511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1302 0.6589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1302 0.6589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3546 0.1511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3546 0.1511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8361 1.9537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8361 1.9537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3564 2.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3564 2.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3157 2.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3157 2.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7542 0.4744 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7542 0.4744 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8221 -1.3752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8221 -1.3752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 2 0 0 0 0 | + | 1 2 2 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
| − | 3 4 2 0 0 0 0 | + | 3 4 2 0 0 0 0 |
| − | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
| − | 5 6 2 0 0 0 0 | + | 5 6 2 0 0 0 0 |
| − | 6 1 1 0 0 0 0 | + | 6 1 1 0 0 0 0 |
| − | 3 7 1 0 0 0 0 | + | 3 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 4 1 0 0 0 0 | + | 10 4 1 0 0 0 0 |
| − | 9 11 1 0 0 0 0 | + | 9 11 1 0 0 0 0 |
| − | 7 12 2 0 0 0 0 | + | 7 12 2 0 0 0 0 |
| − | 11 13 2 0 0 0 0 | + | 11 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 17 2 0 0 0 0 | + | 16 17 2 0 0 0 0 |
| − | 17 11 1 0 0 0 0 | + | 17 11 1 0 0 0 0 |
| − | 2 18 1 0 0 0 0 | + | 2 18 1 0 0 0 0 |
| − | 6 19 1 0 0 0 0 | + | 6 19 1 0 0 0 0 |
| − | 5 20 1 0 0 0 0 | + | 5 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 |
| − | 21 24 1 0 0 0 0 | + | 21 24 1 0 0 0 0 |
| − | 24 19 1 0 0 0 0 | + | 24 19 1 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 24 26 1 0 0 0 0 | + | 24 26 1 0 0 0 0 |
| − | 23 27 2 0 0 0 0 | + | 23 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 |
| − | 17 30 1 0 0 0 0 | + | 17 30 1 0 0 0 0 |
| − | 13 31 1 0 0 0 0 | + | 13 31 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FA8NP0003 | + | ID FL2FA8NP0003 |
| − | KNApSAcK_ID C00008541 | + | KNApSAcK_ID C00008541 |
| − | NAME Exiguaflavanone L | + | NAME Exiguaflavanone L |
| − | CAS_RN 156281-22-0 | + | CAS_RN 156281-22-0 |
| − | FORMULA C25H28O6 | + | FORMULA C25H28O6 |
| − | EXACTMASS 424.188588628 | + | EXACTMASS 424.188588628 |
| − | AVERAGEMASS 424.48622 | + | AVERAGEMASS 424.48622 |
| − | SMILES c(c34)(c1c(cc(OC(C(CC=C(C)C)C4)(C)C)3)O)OC(c(c(O)2)c(O)ccc2)CC1=O | + | SMILES c(c34)(c1c(cc(OC(C(CC=C(C)C)C4)(C)C)3)O)OC(c(c(O)2)c(O)ccc2)CC1=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/
31 34 0 0 0 0 0 0 0 0999 V2000
-1.3162 -1.3526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7953 -1.6533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2744 -1.3526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2744 -0.7511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7953 -0.4504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3162 -0.7511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2465 -1.6533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7673 -1.3526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7673 -0.7511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2465 -0.4504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2877 -0.4507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2465 -2.1772 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8221 -0.7592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3564 -0.4507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3564 0.1664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8221 0.4749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2877 0.1664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7953 -2.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8371 -0.4504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7953 0.1511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3157 0.4515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3157 1.0524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8361 1.3529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8371 0.1511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1302 0.6589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3546 0.1511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8361 1.9537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3564 2.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3157 2.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7542 0.4744 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8221 -1.3752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
2 3 1 0 0 0 0
3 4 2 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
6 1 1 0 0 0 0
3 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 4 1 0 0 0 0
9 11 1 0 0 0 0
7 12 2 0 0 0 0
11 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 17 2 0 0 0 0
17 11 1 0 0 0 0
2 18 1 0 0 0 0
6 19 1 0 0 0 0
5 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
21 24 1 0 0 0 0
24 19 1 0 0 0 0
24 25 1 0 0 0 0
24 26 1 0 0 0 0
23 27 2 0 0 0 0
27 28 1 0 0 0 0
27 29 1 0 0 0 0
17 30 1 0 0 0 0
13 31 1 0 0 0 0
S SKP 8
ID FL2FA8NP0003
KNApSAcK_ID C00008541
NAME Exiguaflavanone L
CAS_RN 156281-22-0
FORMULA C25H28O6
EXACTMASS 424.188588628
AVERAGEMASS 424.48622
SMILES c(c34)(c1c(cc(OC(C(CC=C(C)C)C4)(C)C)3)O)OC(c(c(O)2)c(O)ccc2)CC1=O
M END
