CAS Registry Number®
118525-40-9
CAS Name
Icaritin
Molecular Formula
C21H20O6
Molecular Mass
368.38
Compound Properties
-
Melting Point (1)
239-239.5 °C
Source(s)
- (1) Akai, Saichiro; Yakugaku Zasshi, (1935), 55, 537-99, CAplus
Other Names and Identifiers
InChI
InChI=1S/C21H20O6/c1-11(2)4-9-14-15(22)10-16(23)17-18(24)19(25)20(27-21(14)17)12-5-7-13(26-3)8-6-12/h4-8,10,22-23,25H,9H2,1-3H3
InChIKey
InChIKey=TUUXBSASAQJECY-UHFFFAOYSA-N
SMILES
C(C=C(C)C)C1=C2C(C(=O)C(O)=C(O2)C3=CC=C(OC)C=C3)=C(O)C=C1O
Canonical SMILES
O=C1C(O)=C(OC=2C1=C(O)C=C(O)C2CC=C(C)C)C=3C=CC(OC)=CC3
Other Names for this Substance
- 4H-1-Benzopyran-4-one, 3,5,7-trihydroxy-2-(4-methoxyphenyl)-8-(3-methyl-2-buten-1-yl)-
- 4H-1-Benzopyran-4-one, 3,5,7-trihydroxy-2-(4-methoxyphenyl)-8-(3-methyl-2-butenyl)-
- 3,5,7-Trihydroxy-2-(4-methoxyphenyl)-8-(3-methyl-2-buten-1-yl)-4H-1-benzopyran-4-one
- Icaritin
- AF 40
- 3,5,7-Trihydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)chromen-4-one