Asebotin

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Catalog Number ACM11075153
Product Name Asebotin
CAS Number 11075-15-3
Structure Asebotin
IUPAC Name 1-[2-hydroxy-4-methoxy-6-[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-(4-hydroxyphenyl)propan-1-one
Molecular Weight 450.44
Molecular Formula C22H26O10
Canonical SMILES COC1=CC(=C(C(=C1)OC2C(C(C(C(O2)CO)O)O)O)C(=O)CCC3=CC=C(C=C3)O)O
Inchi InChI=1S/C22H26O10/c1-30-13-8-15(26)18(14(25)7-4-11-2-5-12(24)6-3-11)16(9-13)31-22-21(29)20(28)19(27)17(10-23)32-22/h2-3,5-6,8-9,17,19-24,26-29H,4,7,10H2,1H3/t17-,19+,20+,21+,22+/m0/s1
InChIKey PQCIBORQLVRFMR-PQZYZXGRSA-N
Purity 98%
Appearance Powder

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