Mol:FL3FALNI0007
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 33 0 0 0 0 0 0 0 0999 V2000 | + | 31 33 0 0 0 0 0 0 0 0999 V2000 |
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| − | 19 15 1 0 0 0 0 | + | 19 15 1 0 0 0 0 |
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| − | 8 22 1 0 0 0 0 | + | 8 22 1 0 0 0 0 |
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| − | 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 |
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| − | 29 30 1 0 0 0 0 | + | 29 30 1 0 0 0 0 |
| − | 29 31 1 0 0 0 0 | + | 29 31 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FALNI0007 | + | ID FL3FALNI0007 |
| − | KNApSAcK_ID C00004030 | + | KNApSAcK_ID C00004030 |
| − | NAME Kuwanon T;2-[2,4-Dihydroxy-3-(3-methyl-2-butenyl)phenyl]-5,7-dihydroxy-3-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one | + | NAME Kuwanon T;2-[2,4-Dihydroxy-3-(3-methyl-2-butenyl)phenyl]-5,7-dihydroxy-3-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one |
| − | CAS_RN 100187-66-4 | + | CAS_RN 100187-66-4 |
| − | FORMULA C25H26O6 | + | FORMULA C25H26O6 |
| − | EXACTMASS 422.172938564 | + | EXACTMASS 422.172938564 |
| − | AVERAGEMASS 422.47033999999996 | + | AVERAGEMASS 422.47033999999996 |
| − | SMILES c(c(C(=C(CC=C(C)C)3)Oc(c2C(=O)3)cc(cc2O)O)1)cc(c(CC=C(C)C)c1O)O | + | SMILES c(c(C(=C(CC=C(C)C)3)Oc(c2C(=O)3)cc(cc2O)O)1)cc(c(CC=C(C)C)c1O)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 33 0 0 0 0 0 0 0 0999 V2000
-1.9623 -0.8294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9623 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4060 -1.7930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8497 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8497 -0.8294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4060 -0.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2934 -1.7930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2629 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2629 -0.8294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2934 -0.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2934 -2.2938 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8190 -0.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3860 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9529 -0.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9529 0.1463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3860 0.4737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8190 0.1463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5184 -0.5084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4664 0.3810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4060 -2.4351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2522 0.4736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8190 -1.7929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3751 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9300 -1.7922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4849 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9300 -2.4329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3860 1.1282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9528 1.4554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9528 2.1085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3872 2.4351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5184 2.4351 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
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9 10 1 0 0 0 0
10 5 1 0 0 0 0
7 11 2 0 0 0 0
9 12 1 0 0 0 0
12 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 12 1 0 0 0 0
1 18 1 0 0 0 0
19 15 1 0 0 0 0
3 20 1 0 0 0 0
17 21 1 0 0 0 0
8 22 1 0 0 0 0
22 23 1 0 0 0 0
23 24 2 0 0 0 0
24 25 1 0 0 0 0
24 26 1 0 0 0 0
16 27 1 0 0 0 0
27 28 1 0 0 0 0
28 29 2 0 0 0 0
29 30 1 0 0 0 0
29 31 1 0 0 0 0
S SKP 8
ID FL3FALNI0007
KNApSAcK_ID C00004030
NAME Kuwanon T;2-[2,4-Dihydroxy-3-(3-methyl-2-butenyl)phenyl]-5,7-dihydroxy-3-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one
CAS_RN 100187-66-4
FORMULA C25H26O6
EXACTMASS 422.172938564
AVERAGEMASS 422.47033999999996
SMILES c(c(C(=C(CC=C(C)C)3)Oc(c2C(=O)3)cc(cc2O)O)1)cc(c(CC=C(C)C)c1O)O
M END
