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Frugoside
CAS Registry Number®
546-02-1
CAS Name
FrugosideMolecular Formula
C29H44O9Molecular Mass
536.66Cite this Page
Frugoside. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=546-02-1 (retrieved ) (CAS RN: 546-02-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).ADVERTISEMENT
Compound Properties
Melting Point (1)
160-170 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C29H44O9/c1-15-23(32)24(33)25(34)26(37-15)38-18-5-9-28(14-30)17(12-18)3-4-21-20(28)6-8-27(2)19(7-10-29(21,27)35)16-11-22(31)36-13-16/h11,15,17-21,23-26,30,32-35H,3-10,12-14H2,1-2H3/t15-,17+,18+,19-,20+,21-,23-,24-,25-,26+,27-,28-,29+/m1/s1
InChIKey
InChIKey=WPVGSIBYLZQSIK-ZAFSJQLXSA-N
SMILES
C(O)[C@@]12[C@@]3([C@]([C@]4(O)[C@](C)(CC3)[C@H](CC4)C=5COC(=O)C5)(CC[C@]1(C[C@@H](O[C@H]6[C@H](O)[C@H](O)[C@H](O)[C@@H](C)O6)CC2)[H])[H])[H]
Canonical SMILES
O=C1OCC(=C1)C2CCC3(O)C4CCC5CC(OC6OC(C)C(O)C(O)C6O)CCC5(CO)C4CCC23C
Other Names for this Substance
- Card-20(22)-enolide, 3-[(6-deoxy-β-D-allopyranosyl)oxy]-14,19-dihydroxy-, (3β,5α)-
- Frugoside
- (3β,5α)-3-[(6-Deoxy-β-D-allopyranosyl)oxy]-14,19-dihydroxycard-20(22)-enolide
Deleted or Replaced CAS Registry Numbers
146864-38-2