Mol:FL2FABNI0001
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 33 0 0 0 0 0 0 0 0999 V2000 | + | 31 33 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.3202 -0.8294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3202 -0.8294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3202 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3202 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7639 -1.7930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7639 -1.7930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2076 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2076 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2076 -0.8294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2076 -0.8294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7639 -0.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7639 -0.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6513 -1.7930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6513 -1.7930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0950 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0950 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0950 -0.8294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0950 -0.8294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6513 -0.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6513 -0.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4611 -0.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4611 -0.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0281 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0281 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5950 -0.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5950 -0.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5950 0.1463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5950 0.1463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0281 0.4737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0281 0.4737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4611 0.1463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4611 0.1463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6513 -2.3368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6513 -2.3368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7639 -2.4351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7639 -2.4351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8763 -0.5084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8763 -0.5084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7639 0.1339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7639 0.1339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3200 0.4549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3200 0.4549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3200 1.0971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3200 1.0971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8761 1.4181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8761 1.4181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7639 1.4181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7639 1.4181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0281 1.1282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0281 1.1282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5949 1.4554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5949 1.4554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5949 2.1085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5949 2.1085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0292 2.4351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0292 2.4351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1605 2.4351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1605 2.4351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1618 0.4736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1618 0.4736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8763 0.0611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8763 0.0611 0.0000 C 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 |
| − | 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 |
| − | 7 17 2 0 0 0 0 | + | 7 17 2 0 0 0 0 |
| − | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
| − | 1 19 1 0 0 0 0 | + | 1 19 1 0 0 0 0 |
| − | 6 20 1 0 0 0 0 | + | 6 20 1 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 21 22 2 0 0 0 0 | + | 21 22 2 0 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | 22 24 1 0 0 0 0 | + | 22 24 1 0 0 0 0 |
| − | 15 25 1 0 0 0 0 | + | 15 25 1 0 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 26 27 2 0 0 0 0 | + | 26 27 2 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 |
| − | 14 30 1 0 0 0 0 | + | 14 30 1 0 0 0 0 |
| − | 30 31 1 0 0 0 0 | + | 30 31 1 0 0 0 0 |
| − | M STY 1 1 SUP | + | M STY 1 1 SUP |
| − | M SLB 1 1 1 | + | M SLB 1 1 1 |
| − | M SAL 1 2 30 31 | + | M SAL 1 2 30 31 |
| − | M SBL 1 1 32 | + | M SBL 1 1 32 |
| − | M SMT 1 OCH3 | + | M SMT 1 OCH3 |
| − | M SBV 1 32 -8.4524 3.1691 | + | M SBV 1 32 -8.4524 3.1691 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FABNI0001 | + | ID FL2FABNI0001 |
| − | KNApSAcK_ID C00008267 | + | KNApSAcK_ID C00008267 |
| − | NAME 5,7-Dihydroxy-4'-methoxy-8,3'-di-C-prenylflavanone;Nimbaflavone | + | NAME 5,7-Dihydroxy-4'-methoxy-8,3'-di-C-prenylflavanone;Nimbaflavone |
| − | CAS_RN 93772-44-2 | + | CAS_RN 93772-44-2 |
| − | FORMULA C26H30O5 | + | FORMULA C26H30O5 |
| − | EXACTMASS 422.20932407 | + | EXACTMASS 422.20932407 |
| − | AVERAGEMASS 422.5134 | + | AVERAGEMASS 422.5134 |
| − | SMILES c(c(O)3)(C(=O)1)c(c(CC=C(C)C)c(O)c3)OC(c(c2)cc(c(OC)c2)CC=C(C)C)C1 | + | SMILES c(c(O)3)(C(=O)1)c(c(CC=C(C)C)c(O)c3)OC(c(c2)cc(c(OC)c2)CC=C(C)C)C1 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
31 33 0 0 0 0 0 0 0 0999 V2000
-2.3202 -0.8294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3202 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7639 -1.7930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2076 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2076 -0.8294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7639 -0.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6513 -1.7930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0950 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0950 -0.8294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6513 -0.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4611 -0.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0281 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5950 -0.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5950 0.1463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0281 0.4737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4611 0.1463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6513 -2.3368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7639 -2.4351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8763 -0.5084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7639 0.1339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3200 0.4549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3200 1.0971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8761 1.4181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7639 1.4181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0281 1.1282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5949 1.4554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5949 2.1085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0292 2.4351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1605 2.4351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1618 0.4736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8763 0.0611 0.0000 C 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
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
7 17 2 0 0 0 0
3 18 1 0 0 0 0
1 19 1 0 0 0 0
6 20 1 0 0 0 0
20 21 1 0 0 0 0
21 22 2 0 0 0 0
22 23 1 0 0 0 0
22 24 1 0 0 0 0
15 25 1 0 0 0 0
25 26 1 0 0 0 0
26 27 2 0 0 0 0
27 28 1 0 0 0 0
27 29 1 0 0 0 0
14 30 1 0 0 0 0
30 31 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 30 31
M SBL 1 1 32
M SMT 1 OCH3
M SBV 1 32 -8.4524 3.1691
S SKP 8
ID FL2FABNI0001
KNApSAcK_ID C00008267
NAME 5,7-Dihydroxy-4'-methoxy-8,3'-di-C-prenylflavanone;Nimbaflavone
CAS_RN 93772-44-2
FORMULA C26H30O5
EXACTMASS 422.20932407
AVERAGEMASS 422.5134
SMILES c(c(O)3)(C(=O)1)c(c(CC=C(C)C)c(O)c3)OC(c(c2)cc(c(OC)c2)CC=C(C)C)C1
M END
