Mol:FL5FAAGS0054
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
53 58 0 0 0 0 0 0 0 0999 V2000
-3.8151 1.4142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8151 0.7718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2588 0.4506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7025 0.7718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7025 1.4142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2588 1.7354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1462 0.4506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5899 0.7718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5899 1.4142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1462 1.7354 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1462 -0.0502 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8894 1.8590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3224 1.5316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2445 1.8590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2445 2.5137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3224 2.8410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8894 2.5137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2588 -0.1915 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
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-4.3101 1.7354 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0266 0.3623 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2420 -0.6902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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0.1869 -0.3554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3862 0.3463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2420 0.7091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0427 0.0115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7276 0.0115 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0806 -1.2925 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3862 -1.7022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8071 -0.7135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1809 0.4648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1809 0.8986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7994 0.1077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2654 0.3767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8629 0.0317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8629 -0.5253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3454 -0.8039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8278 -0.5253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8278 0.0317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3454 0.3102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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-0.4212 -1.8822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2960 -2.3495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1507 -1.8822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4387 -2.3810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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-2.3328 -1.8691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9240 -1.8691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2195 -2.3810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9240 -2.8930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3328 -2.8930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9762 -2.3810 0.0000 O 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
4 5 2 0 0 0 0
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6 1 2 0 0 0 0
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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
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9 12 1 0 0 0 0
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20 1 1 0 0 0 0
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4 3 1 0 0 0 0
23 22 1 1 0 0 0
23 24 1 0 0 0 0
24 25 1 0 0 0 0
25 26 1 0 0 0 0
26 27 1 1 0 0 0
27 22 1 1 0 0 0
27 28 1 0 0 0 0
22 29 1 0 0 0 0
23 30 1 0 0 0 0
24 31 1 0 0 0 0
26 21 1 0 0 0 0
28 32 1 0 0 0 0
32 33 2 0 0 0 0
32 34 1 0 0 0 0
34 35 2 0 0 0 0
35 36 1 0 0 0 0
36 37 2 0 0 0 0
37 38 1 0 0 0 0
38 39 2 0 0 0 0
39 40 1 0 0 0 0
40 41 2 0 0 0 0
41 36 1 0 0 0 0
39 42 1 0 0 0 0
29 43 1 0 0 0 0
43 44 2 0 0 0 0
43 45 1 0 0 0 0
45 46 2 0 0 0 0
46 47 1 0 0 0 0
47 48 2 0 0 0 0
48 49 1 0 0 0 0
49 50 2 0 0 0 0
50 51 1 0 0 0 0
51 52 2 0 0 0 0
52 47 1 0 0 0 0
50 53 1 0 0 0 0
S SKP 8
ID FL5FAAGS0054
KNApSAcK_ID C00005867
NAME Platanoside;Kaempferol 3-(2'',3''-di-(E)-p-coumaroylrhamnoside);3-[[6-Deoxy-2,3-bis-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-alpha-L-mannopyranosyl]oxy]-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
CAS_RN 133740-25-7
FORMULA C39H32O14
EXACTMASS 724.179205732
AVERAGEMASS 724.6629800000001
SMILES C(c(c6)ccc(c6)O)=CC(OC(C1OC(C(=O)3)=C(c(c5)ccc(O)c5)Oc(c4)c3c(cc(O)4)O)C(OC(=O)C=Cc(c2)ccc(O)c2)C(C(O1)C)O)=O
M END
