Mol:FL3FALNP0005
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 33 37 0 0 0 0 0 0 0 0999 V2000 | + | 33 37 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.9649 0.2635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9649 0.2635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9649 -0.3789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9649 -0.3789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4086 -0.7001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4086 -0.7001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8523 -0.3789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8523 -0.3789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8523 0.2635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8523 0.2635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4086 0.5846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4086 0.5846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2960 -0.7001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2960 -0.7001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2603 -0.3789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2603 -0.3789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2603 0.2635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2603 0.2635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2960 0.5846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2960 0.5846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2960 -1.2009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2960 -1.2009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8164 0.5845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8164 0.5845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3834 0.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3834 0.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9504 0.5845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9504 0.5845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9504 1.2392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9504 1.2392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3834 1.5666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3834 1.5666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8164 1.2392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8164 1.2392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4086 -1.3422 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4086 -1.3422 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4086 1.2270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4086 1.2270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9649 1.5482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9649 1.5482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5212 1.2270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5212 1.2270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5212 0.5846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5212 0.5846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1441 1.0601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1441 1.0601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9166 1.9118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9166 1.9118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8164 -0.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8164 -0.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3834 -0.3973 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3834 -0.3973 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8057 -1.3420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8057 -1.3420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3138 -1.6353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3138 -1.6353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3138 -2.2211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3138 -2.2211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8210 -1.3424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8210 -1.3424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3834 2.2211 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3834 2.2211 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3595 1.3781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3595 1.3781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1441 1.1231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1441 1.1231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 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 2 0 0 0 0 | + | 8 9 2 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 |
| − | 7 11 2 0 0 0 0 | + | 7 11 2 0 0 0 0 |
| − | 9 12 1 0 0 0 0 | + | 9 12 1 0 0 0 0 |
| − | 12 13 2 0 0 0 0 | + | 12 13 2 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | 14 15 2 0 0 0 0 | + | 14 15 2 0 0 0 0 |
| − | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
| − | 16 17 2 0 0 0 0 | + | 16 17 2 0 0 0 0 |
| − | 17 12 1 0 0 0 0 | + | 17 12 1 0 0 0 0 |
| − | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
| − | 6 19 1 0 0 0 0 | + | 6 19 1 0 0 0 0 |
| − | 19 20 2 0 0 0 0 | + | 19 20 2 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 22 1 1 0 0 0 0 | + | 22 1 1 0 0 0 0 |
| − | 21 23 1 0 0 0 0 | + | 21 23 1 0 0 0 0 |
| − | 21 24 1 0 0 0 0 | + | 21 24 1 0 0 0 0 |
| − | 8 25 1 0 0 0 0 | + | 8 25 1 0 0 0 0 |
| − | 13 26 1 0 0 0 0 | + | 13 26 1 0 0 0 0 |
| − | 26 25 1 0 0 0 0 | + | 26 25 1 0 0 0 0 |
| − | 25 27 1 0 0 0 0 | + | 25 27 1 0 0 0 0 |
| − | 27 28 2 0 0 0 0 | + | 27 28 2 0 0 0 0 |
| − | 28 29 1 0 0 0 0 | + | 28 29 1 0 0 0 0 |
| − | 28 30 1 0 0 0 0 | + | 28 30 1 0 0 0 0 |
| − | 16 31 1 0 0 0 0 | + | 16 31 1 0 0 0 0 |
| − | 15 32 1 0 0 0 0 | + | 15 32 1 0 0 0 0 |
| − | 32 33 1 0 0 0 0 | + | 32 33 1 0 0 0 0 |
| − | M STY 1 1 SUP | + | M STY 1 1 SUP |
| − | M SLB 1 1 1 | + | M SLB 1 1 1 |
| − | M SAL 1 2 32 33 | + | M SAL 1 2 32 33 |
| − | M SBL 1 1 36 | + | M SBL 1 1 36 |
| − | M SMT 1 OCH3 | + | M SMT 1 OCH3 |
| − | M SBV 1 36 -7.4091 4.3829 | + | M SBV 1 36 -7.4091 4.3829 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FALNP0005 | + | ID FL3FALNP0005 |
| − | KNApSAcK_ID C00004055 | + | KNApSAcK_ID C00004055 |
| − | NAME Cycloartomunin;6,12-Dihydroxy-11-methoxy-3,3-dimethyl-8-(2-methyl-1-propenyl)-3H,7H,8H-bis[1]benzopyrano[4,3-b:6',5'-e]pyran-7-one | + | NAME Cycloartomunin;6,12-Dihydroxy-11-methoxy-3,3-dimethyl-8-(2-methyl-1-propenyl)-3H,7H,8H-bis[1]benzopyrano[4,3-b:6',5'-e]pyran-7-one |
| − | CAS_RN 135023-19-7 | + | CAS_RN 135023-19-7 |
| − | FORMULA C26H24O7 | + | FORMULA C26H24O7 |
| − | EXACTMASS 448.152203122 | + | EXACTMASS 448.152203122 |
| − | AVERAGEMASS 448.46456 | + | AVERAGEMASS 448.46456 |
| − | SMILES c(c15)c(OC)c(cc1C(=C4C(C=C(C)C)O5)Oc(c(C(=O)4)2)c(C=3)c(OC(C3)(C)C)cc2O)O | + | SMILES c(c15)c(OC)c(cc1C(=C4C(C=C(C)C)O5)Oc(c(C(=O)4)2)c(C=3)c(OC(C3)(C)C)cc2O)O |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
33 37 0 0 0 0 0 0 0 0999 V2000
-1.9649 0.2635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9649 -0.3789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4086 -0.7001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8523 -0.3789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8523 0.2635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4086 0.5846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2960 -0.7001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2603 -0.3789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2603 0.2635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2960 0.5846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2960 -1.2009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8164 0.5845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3834 0.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9504 0.5845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9504 1.2392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3834 1.5666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8164 1.2392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4086 -1.3422 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4086 1.2270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9649 1.5482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5212 1.2270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5212 0.5846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1441 1.0601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9166 1.9118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8164 -0.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3834 -0.3973 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8057 -1.3420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3138 -1.6353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3138 -2.2211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8210 -1.3424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3834 2.2211 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3595 1.3781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1441 1.1231 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 2 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
7 11 2 0 0 0 0
9 12 1 0 0 0 0
12 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 12 1 0 0 0 0
3 18 1 0 0 0 0
6 19 1 0 0 0 0
19 20 2 0 0 0 0
20 21 1 0 0 0 0
21 22 1 0 0 0 0
22 1 1 0 0 0 0
21 23 1 0 0 0 0
21 24 1 0 0 0 0
8 25 1 0 0 0 0
13 26 1 0 0 0 0
26 25 1 0 0 0 0
25 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
15 32 1 0 0 0 0
32 33 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 32 33
M SBL 1 1 36
M SMT 1 OCH3
M SBV 1 36 -7.4091 4.3829
S SKP 8
ID FL3FALNP0005
KNApSAcK_ID C00004055
NAME Cycloartomunin;6,12-Dihydroxy-11-methoxy-3,3-dimethyl-8-(2-methyl-1-propenyl)-3H,7H,8H-bis[1]benzopyrano[4,3-b:6',5'-e]pyran-7-one
CAS_RN 135023-19-7
FORMULA C26H24O7
EXACTMASS 448.152203122
AVERAGEMASS 448.46456
SMILES c(c15)c(OC)c(cc1C(=C4C(C=C(C)C)O5)Oc(c(C(=O)4)2)c(C=3)c(OC(C3)(C)C)cc2O)O
M END
