Mol:FLID1CNI0005
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 29 32 0 0 0 0 0 0 0 0999 V2000 | + | 29 32 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.0045 0.9012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0045 0.9012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0045 0.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0045 0.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4482 -0.0624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4482 -0.0624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8919 0.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8919 0.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8919 0.9012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8919 0.9012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4482 1.2224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4482 1.2224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3356 -0.0624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3356 -0.0624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2207 0.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2207 0.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2207 0.9012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2207 0.9012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3356 1.2224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3356 1.2224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7768 -0.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7768 -0.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7768 -0.7490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7768 -0.7490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3716 -1.0924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3716 -1.0924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9664 -0.7490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9664 -0.7490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9664 -0.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9664 -0.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3716 0.2812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3716 0.2812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3339 -0.7488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3339 -0.7488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5606 1.2223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5606 1.2223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4482 1.8645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4482 1.8645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0043 2.1856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0043 2.1856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0043 2.8277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0043 2.8277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5604 3.1487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5604 3.1487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4482 3.1487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4482 3.1487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3716 -1.7786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3716 -1.7786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9658 -2.1216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9658 -2.1216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9658 -2.8064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9658 -2.8064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3728 -3.1487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3728 -3.1487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5588 -3.1487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5588 -3.1487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5606 -1.0921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5606 -1.0921 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 |
| − | 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 |
| − | 7 17 1 0 0 0 0 | + | 7 17 1 0 0 0 0 |
| − | 12 17 1 0 0 0 0 | + | 12 17 1 0 0 0 0 |
| − | 1 18 1 0 0 0 0 | + | 1 18 1 0 0 0 0 |
| − | 6 19 1 0 0 0 0 | + | 6 19 1 0 0 0 0 |
| − | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
| − | 20 21 2 0 0 0 0 | + | 20 21 2 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 |
| − | 13 24 1 0 0 0 0 | + | 13 24 1 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 25 26 2 0 0 0 0 | + | 25 26 2 0 0 0 0 |
| − | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
| − | 26 28 1 0 0 0 0 | + | 26 28 1 0 0 0 0 |
| − | 14 29 1 0 0 0 0 | + | 14 29 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FLID1CNI0005 | + | ID FLID1CNI0005 |
| − | KNApSAcK_ID C00010016 | + | KNApSAcK_ID C00010016 |
| − | NAME Erybraedin A;4-Prenylphaseollidin;(6aR,11aR)-3,9-Dihydroxy-4,10-diprenylpterocarpan | + | NAME Erybraedin A;4-Prenylphaseollidin;(6aR,11aR)-3,9-Dihydroxy-4,10-diprenylpterocarpan |
| − | CAS_RN 119269-76-0 | + | CAS_RN 119269-76-0 |
| − | FORMULA C25H28O4 | + | FORMULA C25H28O4 |
| − | EXACTMASS 392.19875938399997 | + | EXACTMASS 392.19875938399997 |
| − | AVERAGEMASS 392.48742 | + | AVERAGEMASS 392.48742 |
| − | SMILES C(C)(C)=CCc(c(O)4)c(c(cc4)1)OCC(c23)C1Oc2c(c(cc3)O)CC=C(C)C | + | SMILES C(C)(C)=CCc(c(O)4)c(c(cc4)1)OCC(c23)C1Oc2c(c(cc3)O)CC=C(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/
29 32 0 0 0 0 0 0 0 0999 V2000
-2.0045 0.9012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0045 0.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4482 -0.0624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8919 0.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8919 0.9012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4482 1.2224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3356 -0.0624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2207 0.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2207 0.9012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3356 1.2224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7768 -0.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7768 -0.7490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3716 -1.0924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9664 -0.7490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9664 -0.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3716 0.2812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3339 -0.7488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5606 1.2223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4482 1.8645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0043 2.1856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0043 2.8277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5604 3.1487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4482 3.1487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3716 -1.7786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9658 -2.1216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9658 -2.8064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3728 -3.1487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5588 -3.1487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5606 -1.0921 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
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
7 17 1 0 0 0 0
12 17 1 0 0 0 0
1 18 1 0 0 0 0
6 19 1 0 0 0 0
19 20 1 0 0 0 0
20 21 2 0 0 0 0
21 22 1 0 0 0 0
21 23 1 0 0 0 0
13 24 1 0 0 0 0
24 25 1 0 0 0 0
25 26 2 0 0 0 0
26 27 1 0 0 0 0
26 28 1 0 0 0 0
14 29 1 0 0 0 0
S SKP 8
ID FLID1CNI0005
KNApSAcK_ID C00010016
NAME Erybraedin A;4-Prenylphaseollidin;(6aR,11aR)-3,9-Dihydroxy-4,10-diprenylpterocarpan
CAS_RN 119269-76-0
FORMULA C25H28O4
EXACTMASS 392.19875938399997
AVERAGEMASS 392.48742
SMILES C(C)(C)=CCc(c(O)4)c(c(cc4)1)OCC(c23)C1Oc2c(c(cc3)O)CC=C(C)C
M END
