Mol:FL7DCANS0001
From Metabolomics.JP
(Difference between revisions)
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20 22 0 0 0 0 0 0 0 0999 V2000 | 20 22 0 0 0 0 0 0 0 0999 V2000 | ||
-0.7144 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | -0.7144 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | ||
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M CHG 1 3 1 | M CHG 1 3 1 | ||
− | S SKP | + | S SKP 9 |
+ | AUTODRAW FALSE | ||
ID FL7DCANS0001 | ID FL7DCANS0001 | ||
+ | KNApSAcK_ID | ||
+ | NAME 7-O-Methylapigeninidin | ||
+ | CAS_RN 170310-02-8 | ||
FORMULA C16H13O4 | FORMULA C16H13O4 | ||
EXACTMASS 269.081383904 | EXACTMASS 269.081383904 |
Latest revision as of 16:06, 5 December 2012
Copyright: ARM project http://www.metabolome.jp/ 20 22 0 0 0 0 0 0 0 0999 V2000 -0.7144 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7144 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 0.6188 0.0000 O 0 3 0 0 0 4 0 0 0 0 0 0 -1.4290 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 -1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1434 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1434 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -1.8562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8579 0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5723 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 1.8562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5723 1.8562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 1 3 1 0 1 4 2 0 2 5 2 0 2 6 1 0 3 7 2 0 4 8 1 0 5 9 1 0 5 10 1 0 6 11 2 0 7 11 1 0 7 12 1 0 8 9 2 0 8 13 1 0 12 14 1 0 12 15 2 0 13 16 1 0 14 17 2 0 15 18 1 0 17 19 1 0 18 19 2 0 19 20 1 0 M CHG 1 3 1 S SKP 9 AUTODRAW FALSE ID FL7DCANS0001 KNApSAcK_ID NAME 7-O-Methylapigeninidin CAS_RN 170310-02-8 FORMULA C16H13O4 EXACTMASS 269.081383904 AVERAGEMASS 269.27202 SMILES COc(c1)cc([o+1]2)c(ccc2c(c3)ccc(O)c3)c(O)1 M END