Mol:FL6F1ANS0004
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
18 20 0 0 0 0 0 0 0 0999 V2000
-1.0631 -1.0418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0631 -0.2168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7776 0.1957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4920 -0.2168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4920 -1.0418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7776 -1.4543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3486 -1.4543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3658 -1.0418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3658 -0.2168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3486 0.1957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2431 0.2896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9155 -0.0986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5879 0.2896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5879 1.0661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9155 1.4543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2431 1.0661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1385 1.3840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1385 0.1564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2 1 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
1 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 2 1 0 0 0 0
9 11 1 1 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
14 17 1 0 0 0 0
4 18 1 0 0 0 0
S SKP 8
ID FL6F1ANS0004
KNApSAcK_ID C00013245
NAME Tupichinol C;(R)-3,4-Dihydro-2-(4-hydroxyphenyl)-2H-1-benzopyran-7-ol
CAS_RN 118204-66-3
FORMULA C15H14O3
EXACTMASS 242.094294314
AVERAGEMASS 242.26986000000002
SMILES Oc(c3)ccc(c3)C(C1)Oc(c2)c(ccc(O)2)C1
M END
