Mol:FL2FADNP0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
32 35 0 0 0 0 0 0 0 0999 V2000
-1.3065 -0.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7857 -1.2023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2648 -0.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2648 -0.3001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7857 0.0006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3065 -0.3001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2561 -1.2023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7770 -0.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7770 -0.3001 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
0.2561 0.0006 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2974 0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2561 -1.7262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8317 -0.3082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3661 0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3661 0.6173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8317 0.9258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2974 0.6173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7857 -1.8032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3661 0.6173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8269 0.0003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7857 0.6015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8269 -1.2020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3473 -0.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3473 -0.3007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6833 0.2812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8996 -0.4487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3060 0.9019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3060 1.5028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8264 1.8032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7857 1.8032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0985 1.4923 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5246 2.3970 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 0 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
2 18 1 0 0 0 0
15 19 1 0 0 0 0
6 20 1 0 0 0 0
5 21 1 0 0 0 0
1 22 1 0 0 0 0
22 23 2 0 0 0 0
20 24 1 0 0 0 0
24 23 1 0 0 0 0
24 25 1 0 0 0 0
24 26 1 0 0 0 0
21 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
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 31 32
M SBL 1 1 34
M SMT 1 OCH3
M SVB 1 34 2.0985 1.4923
S SKP 8
ID FL2FADNP0002
KNApSAcK_ID C00008514
NAME 3'-Methoxylupinifolin
CAS_RN 144049-80-9
FORMULA C26H28O6
EXACTMASS 436.188588628
AVERAGEMASS 436.49692
SMILES O(c(c4O)cc(cc4)C(O3)CC(=O)c(c31)c(c(C=2)c(OC(C2)(C)C)c1CC=C(C)C)O)C
M END
