Mol:FL5FACNI0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 27 29 0 0 0 0 0 0 0 0999 V2000 | + | 27 29 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.1318 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1318 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1318 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1318 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5755 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5755 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0192 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0192 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0192 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0192 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5755 0.1452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5755 0.1452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5371 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5371 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0934 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0934 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0934 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0934 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5371 0.1452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5371 0.1452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5371 -1.6403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5371 -1.6403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6495 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6495 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2165 -0.1822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2165 -0.1822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7834 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7834 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7834 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7834 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2165 1.1271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2165 1.1271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6495 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6495 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6732 -1.1247 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6732 -1.1247 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5755 -1.7816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5755 -1.7816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3503 1.1270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3503 1.1270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6879 -1.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6879 -1.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2428 -0.8190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2428 -0.8190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7965 -1.1387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7965 -1.1387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3503 -0.8190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3503 -0.8190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7965 -1.7781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7965 -1.7781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6879 0.1451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6879 0.1451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2165 1.7816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2165 1.7816 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 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 5 1 0 0 0 0 | + | 10 5 1 0 0 0 0 |
| − | 7 11 2 0 0 0 0 | + | 7 11 2 0 0 0 0 |
| − | 9 12 1 0 0 0 0 | + | 9 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 |
| − | 8 18 1 0 0 0 0 | + | 8 18 1 0 0 0 0 |
| − | 3 19 1 0 0 0 0 | + | 3 19 1 0 0 0 0 |
| − | 15 20 1 0 0 0 0 | + | 15 20 1 0 0 0 0 |
| − | 2 21 1 0 0 0 0 | + | 2 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 |
| − | 1 26 1 0 0 0 0 | + | 1 26 1 0 0 0 0 |
| − | 16 27 1 0 0 0 0 | + | 16 27 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL5FACNI0001 | + | ID FL5FACNI0001 |
| − | KNApSAcK_ID C00005012 | + | KNApSAcK_ID C00005012 |
| − | NAME Gancaonin P;2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-6-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one | + | NAME Gancaonin P;2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-6-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one |
| − | CAS_RN 129145-54-6 | + | CAS_RN 129145-54-6 |
| − | FORMULA C20H18O7 | + | FORMULA C20H18O7 |
| − | EXACTMASS 370.10525293 | + | EXACTMASS 370.10525293 |
| − | AVERAGEMASS 370.35272 | + | AVERAGEMASS 370.35272 |
| − | SMILES C(c(c3O)c(O)cc(c31)OC(c(c2)cc(c(O)c2)O)=C(C1=O)O)C=C(C)C | + | SMILES C(c(c3O)c(O)cc(c31)OC(c(c2)cc(c(O)c2)O)=C(C1=O)O)C=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/
27 29 0 0 0 0 0 0 0 0999 V2000
-1.1318 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1318 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5755 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0192 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0192 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5755 0.1452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5371 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0934 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0934 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5371 0.1452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5371 -1.6403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6495 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2165 -0.1822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7834 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7834 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2165 1.1271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6495 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6732 -1.1247 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5755 -1.7816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3503 1.1270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6879 -1.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2428 -0.8190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7965 -1.1387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3503 -0.8190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7965 -1.7781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6879 0.1451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2165 1.7816 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 2 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
7 11 2 0 0 0 0
9 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
8 18 1 0 0 0 0
3 19 1 0 0 0 0
15 20 1 0 0 0 0
2 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
1 26 1 0 0 0 0
16 27 1 0 0 0 0
S SKP 8
ID FL5FACNI0001
KNApSAcK_ID C00005012
NAME Gancaonin P;2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-6-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one
CAS_RN 129145-54-6
FORMULA C20H18O7
EXACTMASS 370.10525293
AVERAGEMASS 370.35272
SMILES C(c(c3O)c(O)cc(c31)OC(c(c2)cc(c(O)c2)O)=C(C1=O)O)C=C(C)C
M END
