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HF0

Summary
Name:(2S,3S)-3,5-dihydroxy-7-methoxy-2-(3,4,5-trihydroxyphenyl)chroman-4-one
Formula:C16 H14 O8
Formal charge:0
Formula weight:334.278 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7(2~{S},3~{S})-7-methoxy-3,5-bis(oxidanyl)-2-[3,4,5-tris(oxidanyl)phenyl]-2,3-dihydrochromen-4-one

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C16H14O8/c1-23-7-4-8(17)12-11(5-7)24-16(15(22)14(12)21)6-2-9(18)13(20)10(19)3-6/h2-5,15-20,22H,1H3/t15-,16+/m1/s1
InChIKeyInChI1.03OEYMPTGVGRACKD-CVEARBPZSA-N
SMILES_CANONICALCACTVS3.385COc1cc(O)c2C(=O)[C@@H](O)[C@@H](Oc2c1)c3cc(O)c(O)c(O)c3
SMILESCACTVS3.385COc1cc(O)c2C(=O)[CH](O)[CH](Oc2c1)c3cc(O)c(O)c(O)c3
SMILES_CANONICALOpenEye OEToolkits2.0.7COc1cc(c2c(c1)O[C@H]([C@@H](C2=O)O)c3cc(c(c(c3)O)O)O)O
SMILESOpenEye OEToolkits2.0.7COc1cc(c2c(c1)OC(C(C2=O)O)c3cc(c(c(c3)O)O)O)O

222415

건을2024-07-10부터공개중

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