Isochandalone
CAS Registry Number®
121747-90-8
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CAS Name
IsochandaloneMolecular Formula
C25H24O5Molecular Mass
404.46Cite this Page
Isochandalone. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=121747-90-8 (retrieved ) (CAS RN: 121747-90-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C25H24O5/c1-14(2)5-7-17-19(26)12-21-22(23(17)27)24(28)18(13-29-21)15-6-8-20-16(11-15)9-10-25(3,4)30-20/h5-6,8-13,26-27H,7H2,1-4H3
InChIKey
InChIKey=CUDNUXBRPAPDBJ-UHFFFAOYSA-N
SMILES
O=C1C=2C(=CC(O)=C(CC=C(C)C)C2O)OC=C1C=3C=C4C(=CC3)OC(C)(C)C=C4
Canonical SMILES
O=C1C(=COC2=CC(O)=C(C(O)=C12)CC=C(C)C)C=3C=CC=4OC(C=CC4C3)(C)C
Other Names for this Substance
- 4H-1-Benzopyran-4-one, 3-(2,2-dimethyl-2H-1-benzopyran-6-yl)-5,7-dihydroxy-6-(3-methyl-2-buten-1-yl)-
- 4H-1-Benzopyran-4-one, 3-(2,2-dimethyl-2H-1-benzopyran-6-yl)-5,7-dihydroxy-6-(3-methyl-2-butenyl)-
- 3-(2,2-Dimethyl-2H-1-benzopyran-6-yl)-5,7-dihydroxy-6-(3-methyl-2-buten-1-yl)-4H-1-benzopyran-4-one
- Isochandalone