(Q105256004)

English

3-Hydroxy-3-methyl-5-oxo-5-[[3,4,5-trihydroxy-6-[[5-hydroxy-2-(4-methoxyphenyl)-6,8-dimethyl-4-oxo-2,3-dihydrochromen-7-yl]oxy]oxan-2-yl]methoxy]pentanoic acid

group of stereoisomers with the chemical formula C₃₀H₃₆O₁₄

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instance of

group of stereoisomers

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subclass of

6,8C-substituted flavanone

1 reference

inferred from

6,8C-substituted flavanone

mass

620.2105058319999 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₀H₃₆O₁₄

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canonical SMILES

O=C(O)CC(O)(C)CC(=O)OCC1OC(OC=2C(=C(O)C=3C(=O)CC(OC3C2C)C4=CC=C(OC)C=C4)C)C(O)C(O)C1O

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Identifiers

InChI

InChI=1S/C30H36O14/c1-13-23(35)22-17(31)9-18(15-5-7-16(40-4)8-6-15)42-28(22)14(2)27(13)44-29-26(38)25(37)24(36)19(43-29)12-41-21(34)11-30(3,39)10-20(32)33/h5-8,18-19,24-26,29,35-39H,9-12H2,1-4H3,(H,32,33)

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InChIKey

SMLRKPPCBXFZQW-UHFFFAOYSA-N

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PubChem CID

53463456

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

SMLRKPPCBXFZQW-UHFFFAOYSA-N

1 reference

(Q105256004)

3-Hydroxy-3-methyl-5-oxo-5-[[3,4,5-trihydroxy-6-[[5-hydroxy-2-(4-methoxyphenyl)-6,8-dimethyl-4-oxo-2,3-dihydrochromen-7-yl]oxy]oxan-2-yl]methoxy]pentanoic acid

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