Mol:FLIC1LNP0009
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 33 0 0 0 0 0 0 0 0999 V2000 | + | 29 33 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.9975 0.8672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9975 0.8672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9975 0.2249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9975 0.2249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4412 -0.0963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4412 -0.0963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8849 0.2249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8849 0.2249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8849 0.8672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8849 0.8672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4412 1.1884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4412 1.1884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3286 -0.0963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3286 -0.0963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2277 0.2249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2277 0.2249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2277 0.8672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2277 0.8672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3286 1.1884 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3286 1.1884 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7838 -0.0962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7838 -0.0962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7838 -0.7830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7838 -0.7830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3786 -1.1264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3786 -1.1264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9734 -0.7830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9734 -0.7830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9734 -0.0962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9734 -0.0962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3786 0.2472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3786 0.2472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5536 1.1883 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5536 1.1883 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1896 -1.1260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1896 -1.1260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4412 1.8308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4412 1.8308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9975 2.1520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9975 2.1520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5536 1.8308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5536 1.8308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5536 2.5585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5536 2.5585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1272 1.4996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1272 1.4996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3786 -1.8132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3786 -1.8132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9734 -2.1566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9734 -2.1566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5682 -1.8132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5682 -1.8132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5682 -1.1264 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5682 -1.1264 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5682 -2.5585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5682 -2.5585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1272 -1.4904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1272 -1.4904 0.0000 C 0 0 0 0 0 0 0 0 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 |
| − | 8 11 1 0 0 0 0 | + | 8 11 1 0 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 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 1 17 1 0 0 0 0 | + | 1 17 1 0 0 0 0 |
| − | 12 18 1 0 0 0 0 | + | 12 18 1 0 0 0 0 |
| − | 6 19 1 0 0 0 0 | + | 6 19 1 0 0 0 0 |
| − | 19 20 2 0 0 0 0 | + | 19 20 2 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 21 17 1 0 0 0 0 | + | 21 17 1 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 FLIC1LNP0009 | + | ID FLIC1LNP0009 |
| − | KNApSAcK_ID C00009735 | + | KNApSAcK_ID C00009735 |
| − | NAME Hispaglabridin B | + | NAME Hispaglabridin B |
| − | CAS_RN 68978-02-9 | + | CAS_RN 68978-02-9 |
| − | FORMULA C25H26O4 | + | FORMULA C25H26O4 |
| − | EXACTMASS 390.18310931999997 | + | EXACTMASS 390.18310931999997 |
| − | AVERAGEMASS 390.47153999999995 | + | AVERAGEMASS 390.47153999999995 |
| − | SMILES c(c(O)1)(C(C3)COc(c54)c3ccc4OC(C)(C)C=C5)ccc(O2)c1C=CC(C)(C)2 | + | SMILES c(c(O)1)(C(C3)COc(c54)c3ccc4OC(C)(C)C=C5)ccc(O2)c1C=CC(C)(C)2 |
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 33 0 0 0 0 0 0 0 0999 V2000
-1.9975 0.8672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9975 0.2249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4412 -0.0963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8849 0.2249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8849 0.8672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4412 1.1884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3286 -0.0963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2277 0.2249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2277 0.8672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3286 1.1884 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7838 -0.0962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7838 -0.7830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3786 -1.1264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9734 -0.7830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9734 -0.0962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3786 0.2472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5536 1.1883 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1896 -1.1260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4412 1.8308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9975 2.1520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5536 1.8308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5536 2.5585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1272 1.4996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3786 -1.8132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9734 -2.1566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5682 -1.8132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5682 -1.1264 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5682 -2.5585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1272 -1.4904 0.0000 C 0 0 0 0 0 0 0 0 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
8 11 1 0 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
1 2 1 0 0 0 0
1 17 1 0 0 0 0
12 18 1 0 0 0 0
6 19 1 0 0 0 0
19 20 2 0 0 0 0
20 21 1 0 0 0 0
21 17 1 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 FLIC1LNP0009
KNApSAcK_ID C00009735
NAME Hispaglabridin B
CAS_RN 68978-02-9
FORMULA C25H26O4
EXACTMASS 390.18310931999997
AVERAGEMASS 390.47153999999995
SMILES c(c(O)1)(C(C3)COc(c54)c3ccc4OC(C)(C)C=C5)ccc(O2)c1C=CC(C)(C)2
M END
