Mol:FL5FACGS0112
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
68 74 0 0 0 0 0 0 0 0999 V2000
3.8757 2.7088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1613 3.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1613 3.9463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8757 4.3588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5902 3.9463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5902 3.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4468 2.7088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7323 3.1213 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0179 2.7088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0179 1.8838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7323 1.4713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4468 1.8838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3034 3.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4111 2.7088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4111 1.8838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3034 1.4713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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-1.1256 3.1213 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
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3.4041 0.3734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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2.1835 -0.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6625 0.2019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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1.4472 -1.1827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
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1.7705 -2.6745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1334 -1.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8234 -1.4805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0126 -1.3262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6496 -2.0674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0639 -1.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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2.7239 -2.2183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9414 -4.4124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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-4.4559 -2.8423 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.1821 -2.8423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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S SKP 8
ID FL5FACGS0112
KNApSAcK_ID C00013884
NAME Quercetin 3-(6''''-feruloylglucosyl)-(1->2)-galactosyl-(1->2)-glucoside;3-[[O-6-O-[(2E)-3-(4-Hydroxy-3-methoxyphenyl)-1-oxo-2-propenyl]-beta-D-glucopyranosyl-(1->2)-O-beta-D-galactopyranosyl-(1->2)-beta-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one
CAS_RN 197294-29-4
FORMULA C43H48O25
EXACTMASS 964.2484670859999
AVERAGEMASS 964.82622
SMILES c(c1C=CC(=O)OCC(C2O)OC(OC(C3OC(C4O)C(OC(C(=O)5)=C(c(c7)cc(c(c7)O)O)Oc(c6)c5c(O)cc(O)6)OC(C4O)CO)C(O)C(O)C(O3)CO)C(O)C2O)c(OC)c(cc1)O
M END
