Mol:FLIC1LNP0006
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 30 0 0 0 0 0 0 0 0999 V2000 | + | 26 30 0 0 0 0 0 0 0 0999 V2000 |
− | -1.9490 0.1512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9490 0.1512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.9490 -0.4912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9490 -0.4912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.3927 -0.8124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3927 -0.8124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.8364 -0.4912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8364 -0.4912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.8364 0.1512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8364 0.1512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.3927 0.4724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3927 0.4724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.2801 -0.8124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2801 -0.8124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.2762 -0.4912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2762 -0.4912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.2762 0.1512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2762 0.1512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.2801 0.4724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2801 0.4724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.8323 -0.8122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8323 -0.8122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.8323 -1.4990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8323 -1.4990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.4271 -1.8424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4271 -1.8424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0219 -1.4990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0219 -1.4990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0219 -0.8122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0219 -0.8122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.4271 -0.4688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4271 -0.4688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.5051 0.4722 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5051 0.4722 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.2381 -1.8421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2381 -1.8421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.3927 1.1147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3927 1.1147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.9490 1.4359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9490 1.4359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.5051 1.1147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5051 1.1147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.5051 1.8424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5051 1.8424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.0787 0.7835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0787 0.7835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.6750 -1.7113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6750 -1.7113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.0787 -1.1556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0787 -1.1556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.6750 -0.6000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6750 -0.6000 0.0000 O 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 |
− | 14 24 1 0 0 0 0 | + | 14 24 1 0 0 0 0 |
− | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
− | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
− | 26 15 1 0 0 0 0 | + | 26 15 1 0 0 0 0 |
− | S SKP 8 | + | S SKP 8 |
− | ID FLIC1LNP0006 | + | ID FLIC1LNP0006 |
− | KNApSAcK_ID C00009728 | + | KNApSAcK_ID C00009728 |
− | NAME Leiocin | + | NAME Leiocin |
− | CAS_RN 66446-88-6 | + | CAS_RN 66446-88-6 |
− | FORMULA C21H20O5 | + | FORMULA C21H20O5 |
− | EXACTMASS 352.13107375 | + | EXACTMASS 352.13107375 |
− | AVERAGEMASS 352.3805 | + | AVERAGEMASS 352.3805 |
− | SMILES c(O5)(c1)c(OC5)cc(c(C(C4)Cc(c3)c(O4)c(c(c3)2)C=CC(C)(C)O2)1)O | + | SMILES c(O5)(c1)c(OC5)cc(c(C(C4)Cc(c3)c(O4)c(c(c3)2)C=CC(C)(C)O2)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/ 26 30 0 0 0 0 0 0 0 0999 V2000 -1.9490 0.1512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9490 -0.4912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3927 -0.8124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8364 -0.4912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8364 0.1512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3927 0.4724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2801 -0.8124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2762 -0.4912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2762 0.1512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2801 0.4724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8323 -0.8122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8323 -1.4990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4271 -1.8424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0219 -1.4990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0219 -0.8122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4271 -0.4688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5051 0.4722 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2381 -1.8421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3927 1.1147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9490 1.4359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5051 1.1147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5051 1.8424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0787 0.7835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6750 -1.7113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0787 -1.1556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6750 -0.6000 0.0000 O 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 14 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 15 1 0 0 0 0 S SKP 8 ID FLIC1LNP0006 KNApSAcK_ID C00009728 NAME Leiocin CAS_RN 66446-88-6 FORMULA C21H20O5 EXACTMASS 352.13107375 AVERAGEMASS 352.3805 SMILES c(O5)(c1)c(OC5)cc(c(C(C4)Cc(c3)c(O4)c(c(c3)2)C=CC(C)(C)O2)1)O M END