Cafestol

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Catalog Number ACM469830
CAS 469-83-0
Structure {[CurrentData.Name]}
Molecular Weight 316.44
Molecular Formula C20H28O3
Canonical SMILES CC12CCC3=C(C1CCC45C2CCC(C4)C(C5)(CO)O)C=CO3
Inchi InChI=1S/C20H28O3/c1-18-7-5-16-14(6-9-23-16)15(18)4-8-19-10-13(2-3-17(18)19)20(22,11-19)12-21/h6,9,13,15,17,21-22H,2-5,7-8,10-12H2,1H3/t13-,15-,17+,18-,19+,20+/m1/s1
InChIKey DNJVYWXIDISQRD-HWUKTEKMSA-N
Purity 98%
Appearance White powder

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