1-[8-[(2-O-D-Apio-β-D-furanosyl-β-D-glucopyranosyl)oxy]-1-hydroxy-6-methoxy-3-methyl-2-naphthalenyl]ethanone
CAS Registry Number®
245724-11-2
CAS Name
1-[8-[(2-O-D-Apio-β-D-furanosyl-β-D-glucopyranosyl)oxy]-1-hydroxy-6-methoxy-3-methyl-2-naphthalenyl]ethanoneMolecular Formula
C25H32O13Molecular Mass
540.51Cite this Page
1-[8-[(2-O-D-Apio-β-D-furanosyl-β-D-glucopyranosyl)oxy]-1-hydroxy-6-methoxy-3-methyl-2-naphthalenyl]ethanone. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=245724-11-2 (retrieved ) (CAS RN: 245724-11-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C25H32O13/c1-10-4-12-5-13(34-3)6-14(17(12)19(30)16(10)11(2)28)36-23-21(20(31)18(29)15(7-26)37-23)38-24-22(32)25(33,8-27)9-35-24/h4-6,15,18,20-24,26-27,29-33H,7-9H2,1-3H3/t15-,18-,20+,21-,22+,23-,24+,25-/m1/s1
InChIKey
InChIKey=BABLZVVVBXCYEN-GWSJGPRZSA-N
SMILES
O(C=1C2=C(C=C(OC)C1)C=C(C)C(C(C)=O)=C2O)[C@H]3[C@H](O[C@H]4[C@H](O)[C@](CO)(O)CO4)[C@@H](O)[C@H](O)[C@@H](CO)O3
Canonical SMILES
O=C(C1=C(O)C=2C(OC3OC(CO)C(O)C(O)C3OC4OCC(O)(CO)C4O)=CC(OC)=CC2C=C1C)C
Other Names for this Substance
- Ethanone, 1-[8-[(2-O-D-apio-β-D-furanosyl-β-D-glucopyranosyl)oxy]-1-hydroxy-6-methoxy-3-methyl-2-naphthalenyl]-
- 1-[8-[(2-O-D-Apio-β-D-furanosyl-β-D-glucopyranosyl)oxy]-1-hydroxy-6-methoxy-3-methyl-2-naphthalenyl]ethanone