Mol:FL2FALNP0006
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 34 0 0 0 0 0 0 0 0999 V2000 | + | 31 34 0 0 0 0 0 0 0 0999 V2000 |
− | -1.3846 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3846 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.3846 -0.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3846 -0.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.8283 -1.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8283 -1.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.2720 -0.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2720 -0.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.2720 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2720 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.8283 0.0002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8283 0.0002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.2844 -1.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2844 -1.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.8407 -0.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8407 -0.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.8407 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8407 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.2844 0.0002 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2844 0.0002 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.3967 0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3967 0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.9637 -0.3272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9637 -0.3272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.5307 0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5307 0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.5307 0.6548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5307 0.6548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.9637 0.9821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9637 0.9821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.3967 0.6548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3967 0.6548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.2844 -1.8283 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2844 -1.8283 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.8283 -1.9266 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8283 -1.9266 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.0975 0.9821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0975 0.9821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.8283 0.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8283 0.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.3843 0.9634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3843 0.9634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.3843 1.6055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3843 1.6055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.9404 1.9266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9404 1.9266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.8283 1.9266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8283 1.9266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.8299 0.9821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8299 0.9821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.9409 0.0002 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9409 0.0002 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4972 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4972 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4972 -0.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4972 -0.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.9409 -1.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9409 -1.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.0333 -0.0114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0333 -0.0114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.0975 -0.4818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0975 -0.4818 0.0000 C 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 |
− | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
− | 14 19 1 0 0 0 0 | + | 14 19 1 0 0 0 0 |
− | 6 20 1 0 0 0 0 | + | 6 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 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
− | 22 24 1 0 0 0 0 | + | 22 24 1 0 0 0 0 |
− | 16 25 1 0 0 0 0 | + | 16 25 1 0 0 0 0 |
− | 1 26 1 0 0 0 0 | + | 1 26 1 0 0 0 0 |
− | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
− | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
− | 28 29 2 0 0 0 0 | + | 28 29 2 0 0 0 0 |
− | 29 2 1 0 0 0 0 | + | 29 2 1 0 0 0 0 |
− | 27 30 1 0 0 0 0 | + | 27 30 1 0 0 0 0 |
− | 27 31 1 0 0 0 0 | + | 27 31 1 0 0 0 0 |
− | S SKP 8 | + | S SKP 8 |
− | ID FL2FALNP0006 | + | ID FL2FALNP0006 |
− | KNApSAcK_ID C00008359 | + | KNApSAcK_ID C00008359 |
− | NAME Flemichin D | + | NAME Flemichin D |
− | CAS_RN 57096-07-8 | + | CAS_RN 57096-07-8 |
− | FORMULA C25H26O6 | + | FORMULA C25H26O6 |
− | EXACTMASS 422.172938564 | + | EXACTMASS 422.172938564 |
− | AVERAGEMASS 422.47033999999996 | + | AVERAGEMASS 422.47033999999996 |
− | SMILES c(O3)(c(C(CC(c(c4)c(O)cc(O)c4)3)=O)2)c(CC=C(C)C)c(O1)c(c2O)C=CC1(C)C | + | SMILES c(O3)(c(C(CC(c(c4)c(O)cc(O)c4)3)=O)2)c(CC=C(C)C)c(O1)c(c2O)C=CC1(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/ 31 34 0 0 0 0 0 0 0 0999 V2000 -1.3846 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3846 -0.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8283 -1.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -0.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8283 0.0002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2844 -1.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8407 -0.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8407 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2844 0.0002 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3967 0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9637 -0.3272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5307 0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5307 0.6548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9637 0.9821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3967 0.6548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2844 -1.8283 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8283 -1.9266 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0975 0.9821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8283 0.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3843 0.9634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3843 1.6055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9404 1.9266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8283 1.9266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8299 0.9821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9409 0.0002 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4972 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4972 -0.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9409 -1.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0333 -0.0114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0975 -0.4818 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 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 3 18 1 0 0 0 0 14 19 1 0 0 0 0 6 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 16 25 1 0 0 0 0 1 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 29 2 1 0 0 0 0 27 30 1 0 0 0 0 27 31 1 0 0 0 0 S SKP 8 ID FL2FALNP0006 KNApSAcK_ID C00008359 NAME Flemichin D CAS_RN 57096-07-8 FORMULA C25H26O6 EXACTMASS 422.172938564 AVERAGEMASS 422.47033999999996 SMILES c(O3)(c(C(CC(c(c4)c(O)cc(O)c4)3)=O)2)c(CC=C(C)C)c(O1)c(c2O)C=CC1(C)C M END