Mol:FL5FACNP0004
From Metabolomics.JP
(Difference between revisions)
| Line 1: | Line 1: | ||
| − | + | ||
| − | + | ||
| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 37 40 0 0 0 0 0 0 0 0999 V2000 | + | 37 40 0 0 0 0 0 0 0 0999 V2000 |
| − | 2.4905 -1.7830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4905 -1.7830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4879 -0.9713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4879 -0.9713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7836 -0.5678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7836 -0.5678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0820 -0.9759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0820 -0.9759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0847 -1.7876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0847 -1.7876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7889 -2.1911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7889 -2.1911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1895 -0.5632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1895 -0.5632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1869 0.2485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1869 0.2485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4826 0.6520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4826 0.6520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7810 0.2439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7810 0.2439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4797 1.5572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4797 1.5572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1673 1.9571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1673 1.9571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1647 2.7526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1647 2.7526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4745 3.1481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4745 3.1481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7869 2.7481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7869 2.7481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7895 1.9527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7895 1.9527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3364 3.0063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3364 3.0063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4725 3.7645 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4725 3.7645 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7672 0.5861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7672 0.5861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7342 -0.8753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7342 -0.8753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0204 -2.0867 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0204 -2.0867 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3861 -0.5771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3861 -0.5771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3073 -0.9804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3073 -0.9804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3047 -1.7825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3047 -1.7825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3913 -2.1813 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3913 -2.1813 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7970 -3.3685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7970 -3.3685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4570 -3.7645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4570 -3.7645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0840 -3.3190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0840 -3.3190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0840 -2.7241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0840 -2.7241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7270 -3.6902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7270 -3.6902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1895 -2.2135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1895 -2.2135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7775 -1.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7775 -1.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5095 -2.2135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5095 -2.2135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1860 -1.5535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1860 -1.5535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3024 -2.4937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3024 -2.4937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.7672 -2.1347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.7672 -2.1347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1860 -0.8916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1860 -0.8916 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 |
| − | 2 7 1 0 0 0 0 | + | 2 7 1 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 8 9 2 0 0 0 0 | + | 8 9 2 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 10 3 1 0 0 0 0 | + | 10 3 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 |
| − | 15 17 1 0 0 0 0 | + | 15 17 1 0 0 0 0 |
| − | 14 18 1 0 0 0 0 | + | 14 18 1 0 0 0 0 |
| − | 8 19 1 0 0 0 0 | + | 8 19 1 0 0 0 0 |
| − | 7 20 2 0 0 0 0 | + | 7 20 2 0 0 0 0 |
| − | 1 21 1 0 0 0 0 | + | 1 21 1 0 0 0 0 |
| − | 4 22 1 0 0 0 0 | + | 4 22 1 0 0 0 0 |
| − | 22 23 2 0 0 0 0 | + | 22 23 2 0 0 0 0 |
| − | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 25 5 1 0 0 0 0 | + | 25 5 1 0 0 0 0 |
| − | 6 26 1 0 0 0 0 | + | 6 26 1 0 0 0 0 |
| − | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
| − | 27 28 2 0 0 0 0 | + | 27 28 2 0 0 0 0 |
| − | 28 29 1 0 0 0 0 | + | 28 29 1 0 0 0 0 |
| − | 28 30 1 0 0 0 0 | + | 28 30 1 0 0 0 0 |
| − | 24 31 1 0 0 0 0 | + | 24 31 1 0 0 0 0 |
| − | 31 32 1 0 0 0 0 | + | 31 32 1 0 0 0 0 |
| − | 32 33 1 0 0 0 0 | + | 32 33 1 0 0 0 0 |
| − | 33 34 2 0 0 0 0 | + | 33 34 2 0 0 0 0 |
| − | 24 35 1 0 0 0 0 | + | 24 35 1 0 0 0 0 |
| − | 34 36 1 0 0 0 0 | + | 34 36 1 0 0 0 0 |
| − | 34 37 1 0 0 0 0 | + | 34 37 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL5FACNP0004 | + | ID FL5FACNP0004 |
| − | KNApSAcK_ID C00011161 | + | KNApSAcK_ID C00011161 |
| − | NAME Poinsettifolin A;2-(3,4-Dihydroxyphenyl)-3,5-dihydroxy-8-methyl-6-(3-methyl-2-butenyl)-8-(4-methyl-3-pentenyl)-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one | + | NAME Poinsettifolin A;2-(3,4-Dihydroxyphenyl)-3,5-dihydroxy-8-methyl-6-(3-methyl-2-butenyl)-8-(4-methyl-3-pentenyl)-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one |
| − | CAS_RN 211183-24-3 | + | CAS_RN 211183-24-3 |
| − | FORMULA C30H32O7 | + | FORMULA C30H32O7 |
| − | EXACTMASS 504.214803378 | + | EXACTMASS 504.214803378 |
| − | AVERAGEMASS 504.57088 | + | AVERAGEMASS 504.57088 |
| − | SMILES Oc(c31)c(CC=C(C)C)c(O4)c(C=CC(CCC=C(C)C)(C)4)c1OC(=C(O)C3=O)c(c2)ccc(O)c(O)2 | + | SMILES Oc(c31)c(CC=C(C)C)c(O4)c(C=CC(CCC=C(C)C)(C)4)c1OC(=C(O)C3=O)c(c2)ccc(O)c(O)2 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
37 40 0 0 0 0 0 0 0 0999 V2000
2.4905 -1.7830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4879 -0.9713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7836 -0.5678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0820 -0.9759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0847 -1.7876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7889 -2.1911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1895 -0.5632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1869 0.2485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4826 0.6520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7810 0.2439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4797 1.5572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1673 1.9571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1647 2.7526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4745 3.1481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7869 2.7481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7895 1.9527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3364 3.0063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4725 3.7645 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7672 0.5861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7342 -0.8753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0204 -2.0867 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3861 -0.5771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3073 -0.9804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3047 -1.7825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3913 -2.1813 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7970 -3.3685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4570 -3.7645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0840 -3.3190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0840 -2.7241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7270 -3.6902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1895 -2.2135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7775 -1.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5095 -2.2135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1860 -1.5535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3024 -2.4937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7672 -2.1347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1860 -0.8916 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
2 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 2 0 0 0 0
9 10 1 0 0 0 0
10 3 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
15 17 1 0 0 0 0
14 18 1 0 0 0 0
8 19 1 0 0 0 0
7 20 2 0 0 0 0
1 21 1 0 0 0 0
4 22 1 0 0 0 0
22 23 2 0 0 0 0
23 24 1 0 0 0 0
24 25 1 0 0 0 0
25 5 1 0 0 0 0
6 26 1 0 0 0 0
26 27 1 0 0 0 0
27 28 2 0 0 0 0
28 29 1 0 0 0 0
28 30 1 0 0 0 0
24 31 1 0 0 0 0
31 32 1 0 0 0 0
32 33 1 0 0 0 0
33 34 2 0 0 0 0
24 35 1 0 0 0 0
34 36 1 0 0 0 0
34 37 1 0 0 0 0
S SKP 8
ID FL5FACNP0004
KNApSAcK_ID C00011161
NAME Poinsettifolin A;2-(3,4-Dihydroxyphenyl)-3,5-dihydroxy-8-methyl-6-(3-methyl-2-butenyl)-8-(4-methyl-3-pentenyl)-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one
CAS_RN 211183-24-3
FORMULA C30H32O7
EXACTMASS 504.214803378
AVERAGEMASS 504.57088
SMILES Oc(c31)c(CC=C(C)C)c(O4)c(C=CC(CCC=C(C)C)(C)4)c1OC(=C(O)C3=O)c(c2)ccc(O)c(O)2
M END
