Mol:FL2FALNP0018
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 37 40 0 0 0 0 0 0 0 0999 V2000 | + | 37 40 0 0 0 0 0 0 0 0999 V2000 |
| − | -0.3232 -0.4693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3232 -0.4693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1977 -0.7701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1977 -0.7701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7186 -0.4693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7186 -0.4693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7186 0.1321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7186 0.1321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1977 0.4329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1977 0.4329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3232 0.1321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3232 0.1321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2395 -0.7701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2395 -0.7701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7603 -0.4693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7603 -0.4693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7603 0.1321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7603 0.1321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2395 0.4329 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2395 0.4329 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2807 0.4326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2807 0.4326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2395 -1.2940 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2395 -1.2940 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8151 0.1241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8151 0.1241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3494 0.4326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3494 0.4326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3494 1.0496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3494 1.0496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8151 1.3581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8151 1.3581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2807 1.0496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2807 1.0496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1977 -1.3709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1977 -1.3709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7472 1.3576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7472 1.3576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8151 -0.4919 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8151 -0.4919 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8829 1.3576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8829 1.3576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8441 0.4329 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8441 0.4329 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1977 1.0343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1977 1.0343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3232 1.3351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3232 1.3351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8441 1.0343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8441 1.0343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1943 1.6409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1943 1.6409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4576 0.8699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4576 0.8699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3339 -1.0529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3339 -1.0529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8443 -0.7582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8443 -0.7582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3539 -1.0524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3539 -1.0524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8636 -0.7582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8636 -0.7582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3733 -1.0524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3733 -1.0524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.8829 -0.7582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8829 -0.7582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3733 -1.6409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3733 -1.6409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8443 -0.1697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8443 -0.1697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3539 0.1246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3539 0.1246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3346 0.1246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3346 0.1246 0.0000 C 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 |
| − | 17 19 1 0 0 0 0 | + | 17 19 1 0 0 0 0 |
| − | 13 20 1 0 0 0 0 | + | 13 20 1 0 0 0 0 |
| − | 15 21 1 0 0 0 0 | + | 15 21 1 0 0 0 0 |
| − | 6 22 1 0 0 0 0 | + | 6 22 1 0 0 0 0 |
| − | 5 23 1 0 0 0 0 | + | 5 23 1 0 0 0 0 |
| − | 23 24 2 0 0 0 0 | + | 23 24 2 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 25 22 1 0 0 0 0 | + | 25 22 1 0 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 25 27 1 0 0 0 0 | + | 25 27 1 0 0 0 0 |
| − | 1 28 1 0 0 0 0 | + | 1 28 1 0 0 0 0 |
| − | 28 29 1 0 0 0 0 | + | 28 29 1 0 0 0 0 |
| − | 29 30 1 0 0 0 0 | + | 29 30 1 0 0 0 0 |
| − | 30 31 1 0 0 0 0 | + | 30 31 1 0 0 0 0 |
| − | 31 32 2 0 0 0 0 | + | 31 32 2 0 0 0 0 |
| − | 32 33 1 0 0 0 0 | + | 32 33 1 0 0 0 0 |
| − | 32 34 1 0 0 0 0 | + | 32 34 1 0 0 0 0 |
| − | 29 35 1 0 0 0 0 | + | 29 35 1 0 0 0 0 |
| − | 35 36 2 0 0 0 0 | + | 35 36 2 0 0 0 0 |
| − | 35 37 1 0 0 0 0 | + | 35 37 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FALNP0018 | + | ID FL2FALNP0018 |
| − | KNApSAcK_ID C00008538 | + | KNApSAcK_ID C00008538 |
| − | NAME Exiguaflavanone I | + | NAME Exiguaflavanone I |
| − | CAS_RN 156281-19-5 | + | CAS_RN 156281-19-5 |
| − | FORMULA C30H34O7 | + | FORMULA C30H34O7 |
| − | EXACTMASS 506.230453442 | + | EXACTMASS 506.230453442 |
| − | AVERAGEMASS 506.58676 | + | AVERAGEMASS 506.58676 |
| − | SMILES C(C)(C)=CCC(C(C)=C)Cc(c21)c(c(C3=O)c(OC(c(c(O)4)c(O)cc(O)c4)C3)c(C=CC(O2)(C)C)1)O | + | SMILES C(C)(C)=CCC(C(C)=C)Cc(c21)c(c(C3=O)c(OC(c(c(O)4)c(O)cc(O)c4)C3)c(C=CC(O2)(C)C)1)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/
37 40 0 0 0 0 0 0 0 0999 V2000
-0.3232 -0.4693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1977 -0.7701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7186 -0.4693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7186 0.1321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1977 0.4329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3232 0.1321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2395 -0.7701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7603 -0.4693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7603 0.1321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2395 0.4329 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2807 0.4326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2395 -1.2940 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8151 0.1241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3494 0.4326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3494 1.0496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8151 1.3581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2807 1.0496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1977 -1.3709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7472 1.3576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8151 -0.4919 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8829 1.3576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8441 0.4329 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1977 1.0343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3232 1.3351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8441 1.0343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1943 1.6409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4576 0.8699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3339 -1.0529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8443 -0.7582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3539 -1.0524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8636 -0.7582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3733 -1.0524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8829 -0.7582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3733 -1.6409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8443 -0.1697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3539 0.1246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3346 0.1246 0.0000 C 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
17 19 1 0 0 0 0
13 20 1 0 0 0 0
15 21 1 0 0 0 0
6 22 1 0 0 0 0
5 23 1 0 0 0 0
23 24 2 0 0 0 0
24 25 1 0 0 0 0
25 22 1 0 0 0 0
25 26 1 0 0 0 0
25 27 1 0 0 0 0
1 28 1 0 0 0 0
28 29 1 0 0 0 0
29 30 1 0 0 0 0
30 31 1 0 0 0 0
31 32 2 0 0 0 0
32 33 1 0 0 0 0
32 34 1 0 0 0 0
29 35 1 0 0 0 0
35 36 2 0 0 0 0
35 37 1 0 0 0 0
S SKP 8
ID FL2FALNP0018
KNApSAcK_ID C00008538
NAME Exiguaflavanone I
CAS_RN 156281-19-5
FORMULA C30H34O7
EXACTMASS 506.230453442
AVERAGEMASS 506.58676
SMILES C(C)(C)=CCC(C(C)=C)Cc(c21)c(c(C3=O)c(OC(c(c(O)4)c(O)cc(O)c4)C3)c(C=CC(O2)(C)C)1)O
M END
