Mol:FL3FGANS0015
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
29 31 0 0 0 0 0 0 0 0999 V2000
-0.3659 0.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3755 0.8416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2985 -0.3882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0420 -0.0033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0631 0.8419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3341 1.2624 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7775 1.2544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0462 1.2464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7877 0.8545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7917 -0.0054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0845 -0.4047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2985 -1.2129 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4913 0.8276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2089 1.2455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2113 2.0710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4958 2.4853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7813 2.0728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0845 -1.2297 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9258 2.4835 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5022 1.2670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0462 2.0713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7541 2.4800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5022 2.0970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5062 -0.4179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5062 -1.2439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7878 -1.6586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2167 -1.6541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2167 -2.4853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9258 -1.2447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
1 3 1 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 2 1 0 0 0 0
7 5 1 0 0 0 0
2 8 2 0 0 0 0
8 9 1 0 0 0 0
9 10 2 0 0 0 0
10 11 1 0 0 0 0
11 1 2 0 0 0 0
3 12 2 0 0 0 0
7 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 7 1 0 0 0 0
11 18 1 0 0 0 0
15 19 1 0 0 0 0
9 20 1 0 0 0 0
8 21 1 0 0 0 0
21 22 1 0 0 0 0
20 23 1 0 0 0 0
10 24 1 0 0 0 0
24 25 1 0 0 0 0
25 26 2 0 0 0 0
25 27 1 0 0 0 0
27 28 1 0 0 0 0
27 29 1 0 0 0 0
S SKP 8
ID FL5FGANS0011
KNApSAcK_ID C00013543
NAME Thymusin 6-isobutyrate;5,6,4'-Trihydroxy-7,8-dimethoxy flavone 6-isobutyrate;5-Hydroxy-2-(4-hydroxyphenyl)-7,8-dimethoxy-4-oxo-4H-1-benzopyran-6-yl ester 2-methyl-propanoic acid
CAS_RN 264608-83-5
FORMULA C21H20O8
EXACTMASS 400.11581761599996
AVERAGEMASS 400.3787
SMILES O(c23)C(=CC(c2c(O)c(OC(=O)C(C)C)c(c(OC)3)OC)=O)c(c1)ccc(O)c1
M END
