Mol:FL3FRNND0002
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 37 42 0 0 0 0 0 0 0 0999 V2000 | + | 37 42 0 0 0 0 0 0 0 0999 V2000 |
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| − | -2.2184 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2184 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | -2.9329 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9329 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | -3.6473 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6473 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6473 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6473 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9329 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9329 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0750 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0750 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6395 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6395 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6395 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6395 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0750 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0750 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3540 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3540 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3540 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3540 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6395 1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6395 1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0750 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0750 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9241 0.2896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9241 0.2896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9266 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9266 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9266 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9266 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7513 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7513 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7894 1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7894 1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9454 1.7852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9454 1.7852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.3618 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.3618 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -5.0763 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.0763 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -5.0763 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.0763 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.3618 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.3618 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -5.4620 0.5920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.4620 0.5920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | 3.4710 -0.2032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4710 -0.2032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | 1 2 2 0 0 0 0 | + | 1 2 2 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
| − | 3 11 2 0 0 0 0 | + | 3 11 2 0 0 0 0 |
| − | 10 4 2 0 0 0 0 | + | 10 4 2 0 0 0 0 |
| − | 4 1 1 0 0 0 0 | + | 4 1 1 0 0 0 0 |
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| − | 8 2 1 0 0 0 0 | + | 8 2 1 0 0 0 0 |
| − | 5 9 2 0 0 0 0 | + | 5 9 2 0 0 0 0 |
| − | 11 10 1 0 0 0 0 | + | 11 10 1 0 0 0 0 |
| − | 4 12 1 0 0 0 0 | + | 4 12 1 0 0 0 0 |
| − | 6 13 1 0 0 0 0 | + | 6 13 1 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 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 7 1 0 0 0 0 | + | 16 7 1 0 0 0 0 |
| − | 15 17 1 0 0 0 0 | + | 15 17 1 0 0 0 0 |
| − | 17 18 2 0 0 0 0 | + | 17 18 2 0 0 0 0 |
| − | 18 19 1 0 0 0 0 | + | 18 19 1 0 0 0 0 |
| − | 19 20 2 0 0 0 0 | + | 19 20 2 0 0 0 0 |
| − | 20 16 1 0 0 0 0 | + | 20 16 1 0 0 0 0 |
| − | 20 25 1 0 0 0 0 | + | 20 25 1 0 0 0 0 |
| − | 17 21 1 0 0 0 0 | + | 17 21 1 0 0 0 0 |
| − | 14 22 1 0 0 0 0 | + | 14 22 1 0 0 0 0 |
| − | 22 21 1 0 0 0 0 | + | 22 21 1 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 |
| − | 18 26 1 0 0 0 0 | + | 18 26 1 0 0 0 0 |
| − | 11 27 1 0 0 0 0 | + | 11 27 1 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | 28 29 1 0 0 0 0 | + | 28 29 1 0 0 0 0 |
| − | 29 30 2 0 0 0 0 | + | 29 30 2 0 0 0 0 |
| − | 30 10 1 0 0 0 0 | + | 30 10 1 0 0 0 0 |
| − | 28 31 1 0 0 0 0 | + | 28 31 1 0 0 0 0 |
| − | 28 32 1 0 0 0 0 | + | 28 32 1 0 0 0 0 |
| − | 24 33 1 0 0 0 0 | + | 24 33 1 0 0 0 0 |
| − | 33 34 1 0 0 0 0 | + | 33 34 1 0 0 0 0 |
| − | 34 35 2 0 0 0 0 | + | 34 35 2 0 0 0 0 |
| − | 35 36 1 0 0 0 0 | + | 35 36 1 0 0 0 0 |
| − | 35 37 1 0 0 0 0 | + | 35 37 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FRNND0002 | + | ID FL3FRNND0002 |
| − | KNApSAcK_ID C00013486 | + | KNApSAcK_ID C00013486 |
| − | NAME Artonin M; 5a,6-Dihydro-1,3,8-trihydroxy-5,11,11-trimethyl-5-(4-methyl-3-pentenyl)-5H,7H,11H-benzofuro[3,4-bc]pyrano[2,3-i]xanthen-7-one | + | NAME Artonin M; 5a,6-Dihydro-1,3,8-trihydroxy-5,11,11-trimethyl-5-(4-methyl-3-pentenyl)-5H,7H,11H-benzofuro[3,4-bc]pyrano[2,3-i]xanthen-7-one |
| − | CAS_RN 151627-66-6 | + | CAS_RN 151627-66-6 |
| − | FORMULA C30H30O7 | + | FORMULA C30H30O7 |
| − | EXACTMASS 502.199153314 | + | EXACTMASS 502.199153314 |
| − | AVERAGEMASS 502.55500000000006 | + | AVERAGEMASS 502.55500000000006 |
| − | SMILES C(C)(C)=CCCC(C56)(Oc(c16)c(O)cc(c1C(O2)=C(C5)C(c(c(O)3)c2cc(O4)c3C=CC4(C)C)=O)O)C | + | SMILES C(C)(C)=CCCC(C56)(Oc(c16)c(O)cc(c1C(O2)=C(C5)C(c(c(O)3)c2cc(O4)c3C=CC4(C)C)=O)O)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/
37 42 0 0 0 0 0 0 0 0999 V2000
-2.2184 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2184 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9329 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9329 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5039 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7895 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7895 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5039 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5039 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.6473 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6473 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9329 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0750 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6395 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6395 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0750 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3540 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3540 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6395 1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0750 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9241 0.2896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9266 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9266 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7513 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7894 1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9454 1.7852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.3618 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.0763 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0763 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3618 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.4620 0.5920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6008 -0.0966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4710 -0.2032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2260 -0.6391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9137 -0.2420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6008 -0.6387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9137 0.5513 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 11 2 0 0 0 0
10 4 2 0 0 0 0
4 1 1 0 0 0 0
1 5 1 0 0 0 0
5 6 1 0 0 0 0
6 7 2 0 0 0 0
7 8 1 0 0 0 0
8 2 1 0 0 0 0
5 9 2 0 0 0 0
11 10 1 0 0 0 0
4 12 1 0 0 0 0
6 13 1 0 0 0 0
13 14 1 0 0 0 0
14 15 1 0 0 0 0
15 16 2 0 0 0 0
16 7 1 0 0 0 0
15 17 1 0 0 0 0
17 18 2 0 0 0 0
18 19 1 0 0 0 0
19 20 2 0 0 0 0
20 16 1 0 0 0 0
20 25 1 0 0 0 0
17 21 1 0 0 0 0
14 22 1 0 0 0 0
22 21 1 0 0 0 0
22 23 1 0 0 0 0
22 24 1 0 0 0 0
18 26 1 0 0 0 0
11 27 1 0 0 0 0
27 28 1 0 0 0 0
28 29 1 0 0 0 0
29 30 2 0 0 0 0
30 10 1 0 0 0 0
28 31 1 0 0 0 0
28 32 1 0 0 0 0
24 33 1 0 0 0 0
33 34 1 0 0 0 0
34 35 2 0 0 0 0
35 36 1 0 0 0 0
35 37 1 0 0 0 0
S SKP 8
ID FL3FRNND0002
KNApSAcK_ID C00013486
NAME Artonin M; 5a,6-Dihydro-1,3,8-trihydroxy-5,11,11-trimethyl-5-(4-methyl-3-pentenyl)-5H,7H,11H-benzofuro[3,4-bc]pyrano[2,3-i]xanthen-7-one
CAS_RN 151627-66-6
FORMULA C30H30O7
EXACTMASS 502.199153314
AVERAGEMASS 502.55500000000006
SMILES C(C)(C)=CCCC(C56)(Oc(c16)c(O)cc(c1C(O2)=C(C5)C(c(c(O)3)c2cc(O4)c3C=CC4(C)C)=O)O)C
M END
