Mol:FLID1CNI0004
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 29 32 0 0 0 0 0 0 0 0999 V2000 | + | 29 32 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.8958 -0.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8958 -0.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8958 -0.7693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8958 -0.7693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3395 -1.0905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3395 -1.0905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7832 -0.7693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7832 -0.7693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | -2.3395 0.1942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3395 0.1942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2269 -1.0905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2269 -1.0905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6706 -0.7693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6706 -0.7693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6706 -0.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6706 -0.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2269 0.1942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2269 0.1942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1145 -1.0904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1145 -1.0904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1145 -1.7772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1145 -1.7772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4803 -2.1206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4803 -2.1206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0751 -1.7772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0751 -1.7772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0751 -1.0904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0751 -1.0904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4803 -0.7470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4803 -0.7470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2252 -1.7770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2252 -1.7770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6693 -2.1203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6693 -2.1203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.4519 0.1941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4519 0.1941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | -2.8956 1.7995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8956 1.7995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | -2.3395 2.1206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3395 2.1206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 2 3 2 0 0 0 0 | + | 2 3 2 0 0 0 0 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 4 5 2 0 0 0 0 | + | 4 5 2 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 6 1 2 0 0 0 0 | + | 6 1 2 0 0 0 0 |
| − | 4 7 1 0 0 0 0 | + | 4 7 1 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 8 9 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 10 5 1 0 0 0 0 | + | 10 5 1 0 0 0 0 |
| − | 8 11 1 0 0 0 0 | + | 8 11 1 0 0 0 0 |
| − | 11 12 2 0 0 0 0 | + | 11 12 2 0 0 0 0 |
| − | 12 13 1 0 0 0 0 | + | 12 13 1 0 0 0 0 |
| − | 13 14 2 0 0 0 0 | + | 13 14 2 0 0 0 0 |
| − | 14 15 1 0 0 0 0 | + | 14 15 1 0 0 0 0 |
| − | 15 16 2 0 0 0 0 | + | 15 16 2 0 0 0 0 |
| − | 16 11 1 0 0 0 0 | + | 16 11 1 0 0 0 0 |
| − | 7 17 1 0 0 0 0 | + | 7 17 1 0 0 0 0 |
| − | 12 17 1 0 0 0 0 | + | 12 17 1 0 0 0 0 |
| − | 14 18 1 0 0 0 0 | + | 14 18 1 0 0 0 0 |
| − | 1 19 1 0 0 0 0 | + | 1 19 1 0 0 0 0 |
| − | 6 20 1 0 0 0 0 | + | 6 20 1 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 21 22 2 0 0 0 0 | + | 21 22 2 0 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | 22 24 1 0 0 0 0 | + | 22 24 1 0 0 0 0 |
| − | 15 25 1 0 0 0 0 | + | 15 25 1 0 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 26 27 2 0 0 0 0 | + | 26 27 2 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | 27 29 1 0 0 0 0 | + | 27 29 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FLID1CNI0004 | + | ID FLID1CNI0004 |
| − | KNApSAcK_ID C00010014 | + | KNApSAcK_ID C00010014 |
| − | NAME Erybraedin C;(6aR,11aR)-3,9-Dihydroxy-4,8-diprenylpterocarpan | + | NAME Erybraedin C;(6aR,11aR)-3,9-Dihydroxy-4,8-diprenylpterocarpan |
| − | CAS_RN 119269-74-8 | + | CAS_RN 119269-74-8 |
| − | FORMULA C25H28O4 | + | FORMULA C25H28O4 |
| − | EXACTMASS 392.19875938399997 | + | EXACTMASS 392.19875938399997 |
| − | AVERAGEMASS 392.48742 | + | AVERAGEMASS 392.48742 |
| − | SMILES C(c(c4O)cc(C13)c(c4)OC(c(c(OC3)2)ccc(O)c2CC=C(C)C)1)C=C(C)C | + | SMILES C(c(c4O)cc(C13)c(c4)OC(c(c(OC3)2)ccc(O)c2CC=C(C)C)1)C=C(C)C |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
29 32 0 0 0 0 0 0 0 0999 V2000
-2.8958 -0.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8958 -0.7693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3395 -1.0905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7832 -0.7693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7832 -0.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3395 0.1942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2269 -1.0905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6706 -0.7693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6706 -0.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2269 0.1942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1145 -1.0904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1145 -1.7772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4803 -2.1206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0751 -1.7772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0751 -1.0904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4803 -0.7470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2252 -1.7770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6693 -2.1203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.4519 0.1941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3395 0.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8956 1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8956 1.7995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4517 2.1206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3395 2.1206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6693 -0.7473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2635 -1.0904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8577 -0.7473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4519 -1.0904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8577 -0.0612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 2 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 2 0 0 0 0
4 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 5 1 0 0 0 0
8 11 1 0 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
7 17 1 0 0 0 0
12 17 1 0 0 0 0
14 18 1 0 0 0 0
1 19 1 0 0 0 0
6 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
25 26 1 0 0 0 0
26 27 2 0 0 0 0
27 28 1 0 0 0 0
27 29 1 0 0 0 0
S SKP 8
ID FLID1CNI0004
KNApSAcK_ID C00010014
NAME Erybraedin C;(6aR,11aR)-3,9-Dihydroxy-4,8-diprenylpterocarpan
CAS_RN 119269-74-8
FORMULA C25H28O4
EXACTMASS 392.19875938399997
AVERAGEMASS 392.48742
SMILES C(c(c4O)cc(C13)c(c4)OC(c(c(OC3)2)ccc(O)c2CC=C(C)C)1)C=C(C)C
M END
