Mol:FL4D1ANI0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
35 37 0 0 0 0 0 0 0 0999 V2000
-2.6419 -1.4102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1210 -1.7109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6001 -1.4102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6001 -0.8087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1210 -0.5080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6419 -0.8087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0792 -1.7109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5583 -1.4102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5583 -0.8087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0792 -0.5080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0380 -0.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0792 -2.2348 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4964 -0.8168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0307 -0.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0307 0.1088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4964 0.4173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0380 0.1088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1623 -0.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0380 -1.7106 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1210 0.0929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6414 0.3934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6414 0.9942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1617 1.2947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1210 1.2947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5642 0.4168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5642 -0.8163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0977 -0.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6300 -0.8156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1623 -0.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6300 -1.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4964 0.9752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0115 1.2684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0115 1.9484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5075 2.2348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4373 2.2075 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
3 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 4 1 0 0 0 0
9 11 1 6 0 0 0
7 12 2 0 0 0 0
11 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 11 1 0 0 0 0
6 18 1 0 0 0 0
8 19 1 1 0 0 0
5 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
14 26 1 0 0 0 0
26 27 1 0 0 0 0
27 28 2 0 0 0 0
28 29 1 0 0 0 0
28 30 1 0 0 0 0
16 31 1 0 0 0 0
31 32 1 0 0 0 0
32 33 2 0 0 0 0
33 34 1 0 0 0 0
33 35 1 0 0 0 0
S SKP 8
ID FL4D1ANI0002
KNApSAcK_ID C00008612
NAME 3,7,4'-Trihydroxy-8,3',5'-triprenylflavanone
CAS_RN 90686-14-9
FORMULA C30H36O5
EXACTMASS 476.256274262
AVERAGEMASS 476.60384000000005
SMILES c(c3)c(O)c(c(c31)OC(c(c2)cc(CC=C(C)C)c(O)c2CC=C(C)C)C(O)C1=O)CC=C(C)C
M END
