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Example: InChI=1S/C9H8O4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3,(H,11,12)
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InChIKey
Source Compound ID
UniChem Compound ID (UCI)
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Searched Compound
UCI:
33921830
InChI:
InChI=1S/C18H18O7/c1-7-5-11(19)9(3)15(20)14(7)18(24)25-12-6-8(2)13(17(22)23)16(21)10(12)4/h5-6,19-21H,1-4H3,(H,22,23)
InChI Key:
COUKTHZXLGYKPK-UHFFFAOYSA-N
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Source Compound ID
Source Name
Source ID
ZINC000013375592
ZINC
9
15471735
PubChem ('Thomson Pharma' subset)
21
10450302
PubChem Compounds
22
70069936
NMRShiftDB
24
J94.606K
Nikkaji
29