(Q115948014)

English

QPUKYMBRXDUSAZ-UHFFFAOYSA-N

group of stereoisomers with the chemical formula C₄₂H₇₄O₁₄

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Statements

group of stereoisomers

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chemical compound

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802.507857048 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₄₂H₇₄O₁₄

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canonical SMILES

OCC1OC(OC2C(O)C(O)C(OC2OC3CCC4(C)C(CCC5(C)C4CC(O)C6C(CCC65C)C(O)(C)CCCC(O)(C)C)C3(C)C)CO)C(O)C(O)C1O

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1 reference

Profiling and multivariate statistical analysis of Panax ginseng based on ultra-high-performance liquid chromatography coupled with quadrupole-time-of-flight mass spectrometry.

Identifiers

InChI=1S/C42H74O14/c1-37(2,51)13-9-14-42(8,52)21-10-16-41(7)28(21)22(45)18-26-39(5)15-12-27(38(3,4)25(39)11-17-40(26,41)6)55-36-34(32(49)30(47)24(20-44)54-36)56-35-33(50)31(48)29(46)23(19-43)53-35/h21-36,43-52H,9-20H2,1-8H3

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QPUKYMBRXDUSAZ-UHFFFAOYSA-N

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