Mol:LBPR02020011
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 32 0 0 0 0 0 0 0 0999 V2000 | + | 31 32 0 0 0 0 0 0 0 0999 V2000 |
− | 13.2321 -3.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 13.2321 -3.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 12.3660 -4.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 12.3660 -4.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 11.5000 -3.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 11.5000 -3.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 11.5000 -2.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 11.5000 -2.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 12.3660 -2.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 12.3660 -2.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 13.2321 -2.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 13.2321 -2.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 10.6340 -2.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 10.6340 -2.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 10.6340 -1.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 10.6340 -1.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 11.5000 -0.7811 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 11.5000 -0.7811 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
− | 14.0981 -2.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 14.0981 -2.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 14.0981 -4.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 14.0981 -4.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 10.6340 -4.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 10.6340 -4.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 11.0000 0.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 11.0000 0.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 10.0000 0.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 10.0000 0.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 9.5000 0.9510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 9.5000 0.9510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 8.5000 0.9510 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 8.5000 0.9510 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
− | 8.0000 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.0000 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 7.0000 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.0000 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 6.5000 2.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.5000 2.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.5000 2.6830 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 | + | 5.5000 2.6830 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
− | 5.0000 3.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.0000 3.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.0000 3.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.0000 3.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 12.0000 0.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 12.0000 0.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 8.0000 0.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.0000 0.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.0000 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.0000 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.5000 4.4151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5000 4.4151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.5000 4.4151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5000 4.4151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0000 3.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 3.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0000 5.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 5.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 12.3660 -1.2811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 12.3660 -1.2811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 12.3660 -5.2811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 12.3660 -5.2811 0.0000 O 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 30 1 6 0 0 0 | + | 9 30 1 6 0 0 0 |
− | 30 5 1 0 0 0 0 | + | 30 5 1 0 0 0 0 |
− | 6 10 1 0 0 0 0 | + | 6 10 1 0 0 0 0 |
− | 1 11 1 0 0 0 0 | + | 1 11 1 0 0 0 0 |
− | 3 12 1 0 0 0 0 | + | 3 12 1 0 0 0 0 |
− | 2 31 1 0 0 0 0 | + | 2 31 1 0 0 0 0 |
− | 9 13 1 0 0 0 0 | + | 9 13 1 0 0 0 0 |
− | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
− | 14 15 1 0 0 0 0 | + | 14 15 1 0 0 0 0 |
− | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
− | 16 17 1 0 0 0 0 | + | 16 17 1 0 0 0 0 |
− | 17 18 1 0 0 0 0 | + | 17 18 1 0 0 0 0 |
− | 18 19 1 0 0 0 0 | + | 18 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 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
− | 9 23 1 1 0 0 0 | + | 9 23 1 1 0 0 0 |
− | 16 24 1 6 0 0 0 | + | 16 24 1 6 0 0 0 |
− | 20 25 1 1 0 0 0 | + | 20 25 1 1 0 0 0 |
− | 22 26 1 0 0 0 0 | + | 22 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 |
− | 27 29 1 0 0 0 0 | + | 27 29 1 0 0 0 0 |
− | S SKP 5 | + | S SKP 5 |
− | ID LBPR02020011 | + | ID LBPR02020011 |
− | FORMULA C29H50O2 | + | FORMULA C29H50O2 |
− | EXACTMASS 430.381080844 | + | EXACTMASS 430.381080844 |
− | AVERAGEMASS 430.7061 | + | AVERAGEMASS 430.7061 |
− | SMILES C([C@H](C)CCC[C@H](CCC[C@](O1)(CCc(c(C)2)c1c(c(c(O)2)C)C)C)C)CCC(C)C | + | SMILES C([C@H](C)CCC[C@H](CCC[C@](O1)(CCc(c(C)2)c1c(c(c(O)2)C)C)C)C)CCC(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 32 0 0 0 0 0 0 0 0999 V2000 13.2321 -3.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3660 -4.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5000 -3.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5000 -2.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3660 -2.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2321 -2.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6340 -2.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6340 -1.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5000 -0.7811 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.0981 -2.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0981 -4.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6340 -4.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0000 0.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0000 0.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5000 0.9510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5000 0.9510 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0000 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0000 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 2.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 2.6830 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0000 3.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 3.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0000 0.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 0.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 4.4151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 4.4151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 5.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3660 -1.2811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3660 -5.2811 0.0000 O 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 30 1 6 0 0 0 30 5 1 0 0 0 0 6 10 1 0 0 0 0 1 11 1 0 0 0 0 3 12 1 0 0 0 0 2 31 1 0 0 0 0 9 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 9 23 1 1 0 0 0 16 24 1 6 0 0 0 20 25 1 1 0 0 0 22 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 S SKP 5 ID LBPR02020011 FORMULA C29H50O2 EXACTMASS 430.381080844 AVERAGEMASS 430.7061 SMILES C([C@H](C)CCC[C@H](CCC[C@](O1)(CCc(c(C)2)c1c(c(c(O)2)C)C)C)C)CCC(C)C M END