Mol:FL5FABGI0029
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
40 43 0 0 0 0 0 0 0 0999 V2000
0.3699 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3699 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0843 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7988 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7988 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0843 -0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5133 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3446 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0591 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0591 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3446 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2277 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9422 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9422 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2277 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5133 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0843 -2.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3446 -2.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6567 0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.5743 0.0884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1618 -0.6260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3637 -0.4169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5704 -0.6260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9829 0.0884 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.7810 -0.1206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1935 0.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5133 -2.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.3712 -0.1251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.9587 -0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.9904 0.8074 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.9512 -1.1314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7736 -0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.3712 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3446 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0591 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0591 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7736 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3446 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0591 2.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3446 2.8875 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 1 0 0 0 0
4 5 2 0 0 0 0
5 6 1 0 0 0 0
6 1 1 0 0 0 0
5 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
11 2 1 0 0 0 0
7 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 7 1 0 0 0 0
3 17 2 0 0 0 0
14 19 1 0 0 0 0
11 18 1 0 0 0 0
9 32 1 0 0 0 0
4 27 1 0 0 0 0
20 21 1 1 0 0 0
21 22 1 1 0 0 0
23 22 1 1 0 0 0
23 24 1 0 0 0 0
24 25 1 0 0 0 0
25 20 1 0 0 0 0
25 26 1 0 0 0 0
22 31 1 0 0 0 0
20 28 1 0 0 0 0
21 29 1 0 0 0 0
26 30 1 0 0 0 0
23 32 1 0 0 0 0
19 33 1 0 0 0 0
8 34 1 0 0 0 0
34 35 1 0 0 0 0
35 36 1 0 0 0 0
36 37 1 0 0 0 0
36 38 1 0 0 0 0
36 39 1 0 0 0 0
39 40 1 0 0 0 0
S SKP 8
ID FL5FABGI0029
KNApSAcK_ID C00014007
NAME Caohuoside D;8-(3''-Hydroxy-3''-methylbutyl)kaempferol 4'-methyl ether 7-glucoside;7-(beta-D-Glucopyranosyloxy)-3,5-dihydroxy-8-(3-methoxy-3-methylbutyl)-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one
CAS_RN 161504-79-6
FORMULA C28H34O12
EXACTMASS 562.2050265519999
AVERAGEMASS 562.56236
SMILES O=C(c13)C(O)=C(c(c4)ccc(c4)OC)Oc1c(CCC(C)(C)OC)c(cc3O)OC(C2O)OC(CO)C(C2O)O
M END
