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(Q105256004)
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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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Statements
instance of
group of stereoisomers
0 references
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
0 references
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)
0 references
InChIKey
SMLRKPPCBXFZQW-UHFFFAOYSA-N
0 references
PubChem CID
53463456
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
SMLRKPPCBXFZQW-UHFFFAOYSA-N
UniChem compound ID
57261296
1 reference
stated in
UniChem
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