Mol:FL7AAGGA0011
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
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− | S SKP 8 | + | S SKP 8 |
− | ID FL7AAGGA0011 | + | ID FL7AAGGA0011 |
− | KNApSAcK_ID C00014783 | + | KNApSAcK_ID C00014783 |
− | NAME Delphinidin 3-O-[2-O-(2-O-(trans-caffeoyl)-beta-D-glucopyranosyl)-6-O-(2-O-(tartaryl)malonyl)-beta-D-galactopyranoside]-7-O-[6-O-(trans-caffeoyl)-beta-D-glucopyranoside] | + | NAME Delphinidin 3-O-[2-O-(2-O-(trans-caffeoyl)-beta-D-glucopyranosyl)-6-O-(2-O-(tartaryl)malonyl)-beta-D-galactopyranoside]-7-O-[6-O-(trans-caffeoyl)-beta-D-glucopyranoside] |
− | CAS_RN 462122-47-0 | + | CAS_RN 462122-47-0 |
− | FORMULA C58H59O36 | + | FORMULA C58H59O36 |
− | EXACTMASS 1331.27860328 | + | EXACTMASS 1331.27860328 |
− | AVERAGEMASS 1332.06746 | + | AVERAGEMASS 1332.06746 |
− | SMILES C(=O)(OC(C(O)=O)C(O)C(O)=O)CC(=O)OCC(C8O)OC(C(C8O)OC(C(OC(=O)C=Cc(c7)cc(O)c(O)c7)6)OC(CO)C(O)C6O)Oc(c4c(c5)cc(c(c(O)5)O)O)cc(c3O)c([o+1]4)cc(c3)OC(O1)C(C(O)C(C(COC(C=Cc(c2)cc(O)c(O)c2)=O)1)O)O | + | SMILES C(=O)(OC(C(O)=O)C(O)C(O)=O)CC(=O)OCC(C8O)OC(C(C8O)OC(C(OC(=O)C=Cc(c7)cc(O)c(O)c7)6)OC(CO)C(O)C6O)Oc(c4c(c5)cc(c(c(O)5)O)O)cc(c3O)c([o+1]4)cc(c3)OC(O1)C(C(O)C(C(COC(C=Cc(c2)cc(O)c(O)c2)=O)1)O)O |
M END | M END | ||
− |
Latest revision as of 09:00, 14 March 2009
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0 0 0 0 83 85 1 0 0 0 0 85 86 2 0 0 0 0 86 87 1 0 0 0 0 87 88 2 0 0 0 0 88 89 1 0 0 0 0 89 90 2 0 0 0 0 90 91 1 0 0 0 0 91 92 2 0 0 0 0 92 87 1 0 0 0 0 90 93 1 0 0 0 0 89 94 1 0 0 0 0 82 83 1 0 0 0 0 S SKP 8 ID FL7AAGGA0011 KNApSAcK_ID C00014783 NAME Delphinidin 3-O-[2-O-(2-O-(trans-caffeoyl)-beta-D-glucopyranosyl)-6-O-(2-O-(tartaryl)malonyl)-beta-D-galactopyranoside]-7-O-[6-O-(trans-caffeoyl)-beta-D-glucopyranoside] CAS_RN 462122-47-0 FORMULA C58H59O36 EXACTMASS 1331.27860328 AVERAGEMASS 1332.06746 SMILES C(=O)(OC(C(O)=O)C(O)C(O)=O)CC(=O)OCC(C8O)OC(C(C8O)OC(C(OC(=O)C=Cc(c7)cc(O)c(O)c7)6)OC(CO)C(O)C6O)Oc(c4c(c5)cc(c(c(O)5)O)O)cc(c3O)c([o+1]4)cc(c3)OC(O1)C(C(O)C(C(COC(C=Cc(c2)cc(O)c(O)c2)=O)1)O)O M END