Mol:FL1C1ANI0034
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 |
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| − | 3.9296 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9296 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.6441 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.6441 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.3585 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.3585 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.3585 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.3585 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.6441 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.6441 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.0730 -0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.0730 -0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2151 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2151 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5006 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5006 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7862 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7862 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7862 1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7862 1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0717 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0717 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3572 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3572 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3572 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3572 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3572 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3572 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3572 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3572 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0717 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0717 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3572 1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3572 1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0717 -0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0717 -0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0717 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0717 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0717 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0717 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7862 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7862 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5006 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5006 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5006 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5006 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2151 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2151 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9296 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9296 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.6441 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.6441 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -5.3585 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.3585 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.6441 -0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.6441 -0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -5.3585 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.3585 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -6.0730 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -6.0730 0.4125 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 |
| − | 4 7 1 0 0 0 0 | + | 4 7 1 0 0 0 0 |
| − | 1 8 1 0 0 0 0 | + | 1 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 11 2 0 0 0 0 | + | 10 11 2 0 0 0 0 |
| − | 10 12 1 0 0 0 0 | + | 10 12 1 0 0 0 0 |
| − | 12 13 2 0 0 0 0 | + | 12 13 2 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | 14 15 2 0 0 0 0 | + | 14 15 2 0 0 0 0 |
| − | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
| − | 16 17 2 0 0 0 0 | + | 16 17 2 0 0 0 0 |
| − | 17 12 1 0 0 0 0 | + | 17 12 1 0 0 0 0 |
| − | 13 18 1 0 0 0 0 | + | 13 18 1 0 0 0 0 |
| − | 15 19 1 0 0 0 0 | + | 15 19 1 0 0 0 0 |
| − | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
| − | 14 21 1 0 0 0 0 | + | 14 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 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 |
| − | 23 25 1 0 0 0 0 | + | 23 25 1 0 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 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 |
| − | 28 30 2 0 0 0 0 | + | 28 30 2 0 0 0 0 |
| − | 28 31 1 0 0 0 0 | + | 28 31 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL1C1ANI0034 | + | ID FL1C1ANI0034 |
| − | KNApSAcK_ID C00014461 | + | KNApSAcK_ID C00014461 |
| − | NAME Xanthoangelol G;3'-(3,7-Dimethyl-6-hydroxyocta-2,7-dienyl)-4,2'-dihydroxy-4'-methoxychalcone | + | NAME Xanthoangelol G;3'-(3,7-Dimethyl-6-hydroxyocta-2,7-dienyl)-4,2'-dihydroxy-4'-methoxychalcone |
| − | CAS_RN 265652-88-8 | + | CAS_RN 265652-88-8 |
| − | FORMULA C26H30O5 | + | FORMULA C26H30O5 |
| − | EXACTMASS 422.20932407 | + | EXACTMASS 422.20932407 |
| − | AVERAGEMASS 422.5134 | + | AVERAGEMASS 422.5134 |
| − | SMILES CC(=C)C(O)CCC(C)=CCc(c(OC)2)c(c(cc2)C(C=Cc(c1)ccc(O)c1)=O)O | + | SMILES CC(=C)C(O)CCC(C)=CCc(c(OC)2)c(c(cc2)C(C=Cc(c1)ccc(O)c1)=O)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/
31 32 0 0 0 0 0 0 0 0999 V2000
3.9296 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9296 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6441 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3585 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3585 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6441 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0730 -0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2151 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7862 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7862 1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3572 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3572 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3572 1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0717 -0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
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-2.5006 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5006 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2151 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9296 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6441 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3585 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6441 -0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.3585 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.0730 0.4125 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
4 7 1 0 0 0 0
1 8 1 0 0 0 0
8 9 2 0 0 0 0
9 10 1 0 0 0 0
10 11 2 0 0 0 0
10 12 1 0 0 0 0
12 13 2 0 0 0 0
13 14 1 0 0 0 0
14 15 2 0 0 0 0
15 16 1 0 0 0 0
16 17 2 0 0 0 0
17 12 1 0 0 0 0
13 18 1 0 0 0 0
15 19 1 0 0 0 0
19 20 1 0 0 0 0
14 21 1 0 0 0 0
21 22 1 0 0 0 0
22 23 2 0 0 0 0
23 24 1 0 0 0 0
23 25 1 0 0 0 0
25 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
28 30 2 0 0 0 0
28 31 1 0 0 0 0
S SKP 8
ID FL1C1ANI0034
KNApSAcK_ID C00014461
NAME Xanthoangelol G;3'-(3,7-Dimethyl-6-hydroxyocta-2,7-dienyl)-4,2'-dihydroxy-4'-methoxychalcone
CAS_RN 265652-88-8
FORMULA C26H30O5
EXACTMASS 422.20932407
AVERAGEMASS 422.5134
SMILES CC(=C)C(O)CCC(C)=CCc(c(OC)2)c(c(cc2)C(C=Cc(c1)ccc(O)c1)=O)O
M END
