Mol:FL1DBANI0001
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 26 27 0 0 0 0 0 0 0 0999 V2000 | + | 26 27 0 0 0 0 0 0 0 0999 V2000 |
− | -2.4367 -0.3466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4367 -0.3466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4367 -1.1716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4367 -1.1716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7223 -1.5841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7223 -1.5841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.0078 -1.1716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0078 -1.1716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.0078 -0.3466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0078 -0.3466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7223 0.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7223 0.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.2933 -1.5841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2933 -1.5841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.4212 -1.1716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4212 -1.1716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.4212 -0.3466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4212 -0.3466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.1356 0.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1356 0.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.8501 -0.3466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8501 -0.3466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.5646 0.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5646 0.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.5646 0.8909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5646 0.8909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.8501 1.3034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8501 1.3034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.1356 0.8909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1356 0.8909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.2933 -2.4091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2933 -2.4091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.1512 0.0659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1512 0.0659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.2933 0.0659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2933 0.0659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.2790 1.3034 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2790 1.3034 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7223 -2.2443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7223 -2.2443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4188 -2.6465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4188 -2.6465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7223 0.9253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7223 0.9253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4986 1.3736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4986 1.3736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4986 2.1959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4986 2.1959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.8269 2.5838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8269 2.5838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.2790 2.6465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2790 2.6465 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 |
− | 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 11 2 0 0 0 0 | + | 10 11 2 0 0 0 0 |
− | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
− | 12 13 2 0 0 0 0 | + | 12 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 10 1 0 0 0 0 | + | 15 10 1 0 0 0 0 |
− | 7 16 2 0 0 0 0 | + | 7 16 2 0 0 0 0 |
− | 1 17 1 0 0 0 0 | + | 1 17 1 0 0 0 0 |
− | 5 18 1 0 0 0 0 | + | 5 18 1 0 0 0 0 |
− | 13 19 1 0 0 0 0 | + | 13 19 1 0 0 0 0 |
− | 3 20 1 0 0 0 0 | + | 3 20 1 0 0 0 0 |
− | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
− | 6 22 1 0 0 0 0 | + | 6 22 1 0 0 0 0 |
− | 22 23 1 0 0 0 0 | + | 22 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 |
− | 24 26 1 0 0 0 0 | + | 24 26 1 0 0 0 0 |
− | S SKP 8 | + | S SKP 8 |
− | ID FL1DBANI0001 | + | ID FL1DBANI0001 |
− | KNApSAcK_ID C00014615 | + | KNApSAcK_ID C00014615 |
− | NAME alpha,beta-Dihydroxanthohumol;4,2',4'-Trihydroxy-6'-methoxy-3'-prenyldihydrochalcone | + | NAME alpha,beta-Dihydroxanthohumol;4,2',4'-Trihydroxy-6'-methoxy-3'-prenyldihydrochalcone |
− | CAS_RN 102448-00-0 | + | CAS_RN 102448-00-0 |
− | FORMULA C21H24O5 | + | FORMULA C21H24O5 |
− | EXACTMASS 356.162373878 | + | EXACTMASS 356.162373878 |
− | AVERAGEMASS 356.41226 | + | AVERAGEMASS 356.41226 |
− | SMILES COc(c2)c(c(c(CC=C(C)C)c(O)2)O)C(=O)CCc(c1)ccc(O)c1 | + | SMILES COc(c2)c(c(c(CC=C(C)C)c(O)2)O)C(=O)CCc(c1)ccc(O)c1 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 26 27 0 0 0 0 0 0 0 0999 V2000 -2.4367 -0.3466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4367 -1.1716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7223 -1.5841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0078 -1.1716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0078 -0.3466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7223 0.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2933 -1.5841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4212 -1.1716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4212 -0.3466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1356 0.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8501 -0.3466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5646 0.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5646 0.8909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8501 1.3034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1356 0.8909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2933 -2.4091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1512 0.0659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2933 0.0659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2790 1.3034 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7223 -2.2443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4188 -2.6465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7223 0.9253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4986 1.3736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4986 2.1959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8269 2.5838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2790 2.6465 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 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 11 2 0 0 0 0 11 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 10 1 0 0 0 0 7 16 2 0 0 0 0 1 17 1 0 0 0 0 5 18 1 0 0 0 0 13 19 1 0 0 0 0 3 20 1 0 0 0 0 20 21 1 0 0 0 0 6 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 S SKP 8 ID FL1DBANI0001 KNApSAcK_ID C00014615 NAME alpha,beta-Dihydroxanthohumol;4,2',4'-Trihydroxy-6'-methoxy-3'-prenyldihydrochalcone CAS_RN 102448-00-0 FORMULA C21H24O5 EXACTMASS 356.162373878 AVERAGEMASS 356.41226 SMILES COc(c2)c(c(c(CC=C(C)C)c(O)2)O)C(=O)CCc(c1)ccc(O)c1 M END