Suspenoidside B

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Catalog Number ACM2161432080
CAS 2161432-08-0
IUPAC Name (1S,4aS,7S,7aS)-7-[[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxymethyl]-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid
Molecular Weight 522.5
Molecular Formula C25H30O12
Canonical SMILES C1CC2C(C1COC(=O)C=CC3=CC=C(C=C3)O)C(OC=C2C(=O)O)OC4C(C(C(C(O4)CO)O)O)O
Inchi InChI=1S/C25H30O12/c26-9-17-20(29)21(30)22(31)25(36-17)37-24-19-13(4-7-15(19)16(11-35-24)23(32)33)10-34-18(28)8-3-12-1-5-14(27)6-2-12/h1-3,5-6,8,11,13,15,17,19-22,24-27,29-31H,4,7,9-10H2,(H,32,33)/b8-3+/t13-,15-,17-,19-,20-,21+,22-,24+,25+/m1/s1
InChIKey MSTXUNFWAMGRBW-JVARUGHRSA-N
Purity 98%
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