(Q105289962)

English

1-[5-[6-Acetyl-5-hydroxy-7-methyl-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynaphthalen-1-yl]-1-hydroxy-3-methyl-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynaphthalen-2-yl]ethanone

group of stereoisomers with the chemical formula C₃₈H₄₂O₁₆

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

754.2472852640003 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₈H₄₂O₁₆

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canonical SMILES

O=C(C1=C(O)C2=C(OC3OC(CO)C(O)C(O)C3O)C=CC(C4=CC=C(OC5OC(CO)C(O)C(O)C5O)C=6C(O)=C(C(=O)C)C(=CC46)C)=C2C=C1C)C

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Identifiers

InChI

InChI=1S/C38H42O16/c1-13-9-19-17(5-7-21(27(19)31(45)25(13)15(3)41)51-37-35(49)33(47)29(43)23(11-39)53-37)18-6-8-22(28-20(18)10-14(2)26(16(4)42)32(28)46)52-38-36(50)34(48)30(44)24(12-40)54-38/h5-10,23-24,29-30,33-40,43-50H,11-12H2,1-4H3

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InChIKey

VNVKFFMGRBLOQQ-UHFFFAOYSA-N

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PubChem CID

162921573

1 reference

based on heuristic

inferred from InChIKey

(Q105289962)

1-[5-[6-Acetyl-5-hydroxy-7-methyl-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynaphthalen-1-yl]-1-hydroxy-3-methyl-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynaphthalen-2-yl]ethanone

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