Mol:FL2FAANP0009
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 25 28 0 0 0 0 0 0 0 0999 V2000 | + | 25 28 0 0 0 0 0 0 0 0999 V2000 |
− | -1.8526 0.1111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8526 0.1111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.8340 -0.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8340 -0.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.0569 -1.0779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0569 -1.0779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.4020 -0.6768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4020 -0.6768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.3878 0.1481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3878 0.1481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.1135 0.5731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1135 0.5731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.3529 -1.1023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3529 -1.1023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.0267 -0.7014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0267 -0.7014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.0175 0.1650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0175 0.1650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.3336 0.5482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3336 0.5482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.7320 0.5775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7320 0.5775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.4230 0.1910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4230 0.1910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.1344 0.5895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1344 0.5895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.1549 1.4143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1549 1.4143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.4431 1.8440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4431 1.8440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.7227 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7227 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.3529 -1.8440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3529 -1.8440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.8794 1.8089 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8794 1.8089 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.5580 0.4969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5580 0.4969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.2448 0.0789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2448 0.0789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.2263 -0.7249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2263 -0.7249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.5209 -1.1107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5209 -1.1107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.7233 0.5574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.7233 0.5574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.8794 -0.0911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8794 -0.0911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.0569 -1.7801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0569 -1.7801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1 2 1 0 0 0 0 | + | 1 2 1 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 |
− | 9 11 1 0 0 0 0 | + | 9 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 |
− | 7 17 2 0 0 0 0 | + | 7 17 2 0 0 0 0 |
− | 18 14 1 0 0 0 0 | + | 18 14 1 0 0 0 0 |
− | 1 19 1 0 0 0 0 | + | 1 19 1 0 0 0 0 |
− | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
− | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
− | 21 22 2 0 0 0 0 | + | 21 22 2 0 0 0 0 |
− | 22 2 1 0 0 0 0 | + | 22 2 1 0 0 0 0 |
− | 20 23 1 0 0 0 0 | + | 20 23 1 0 0 0 0 |
− | 20 24 1 0 0 0 0 | + | 20 24 1 0 0 0 0 |
− | 3 25 1 0 0 0 0 | + | 3 25 1 0 0 0 0 |
− | S SKP 8 | + | S SKP 8 |
− | ID FL2FAANP0009 | + | ID FL2FAANP0009 |
− | KNApSAcK_ID C00014230 | + | KNApSAcK_ID C00014230 |
− | NAME Paratocarpin K;5,4'-Dihydroxy-6'',6''-dimethylpyrano[2'',3'':7,6]flavanone | + | NAME Paratocarpin K;5,4'-Dihydroxy-6'',6''-dimethylpyrano[2'',3'':7,6]flavanone |
− | CAS_RN 170900-13-7 | + | CAS_RN 170900-13-7 |
− | FORMULA C20H18O5 | + | FORMULA C20H18O5 |
− | EXACTMASS 338.115423686 | + | EXACTMASS 338.115423686 |
− | AVERAGEMASS 338.35392 | + | AVERAGEMASS 338.35392 |
− | SMILES C(=O)(C3)c(c2O)c(OC3c(c4)ccc(O)c4)cc(c12)OC(C=C1)(C)C | + | SMILES C(=O)(C3)c(c2O)c(OC3c(c4)ccc(O)c4)cc(c12)OC(C=C1)(C)C |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 25 28 0 0 0 0 0 0 0 0999 V2000 -1.8526 0.1111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 -0.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0569 -1.0779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 -0.6768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3878 0.1481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1135 0.5731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3529 -1.1023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0267 -0.7014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0175 0.1650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3336 0.5482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 0.5775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 0.1910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1344 0.5895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1549 1.4143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4431 1.8440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7227 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3529 -1.8440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8794 1.8089 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 0.4969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2448 0.0789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2263 -0.7249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5209 -1.1107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7233 0.5574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8794 -0.0911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0569 -1.7801 0.0000 O 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 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 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 7 17 2 0 0 0 0 18 14 1 0 0 0 0 1 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 2 1 0 0 0 0 20 23 1 0 0 0 0 20 24 1 0 0 0 0 3 25 1 0 0 0 0 S SKP 8 ID FL2FAANP0009 KNApSAcK_ID C00014230 NAME Paratocarpin K;5,4'-Dihydroxy-6'',6''-dimethylpyrano[2'',3'':7,6]flavanone CAS_RN 170900-13-7 FORMULA C20H18O5 EXACTMASS 338.115423686 AVERAGEMASS 338.35392 SMILES C(=O)(C3)c(c2O)c(OC3c(c4)ccc(O)c4)cc(c12)OC(C=C1)(C)C M END