CAS Registry Number®
37921-38-3
CAS Name
Cimifugin
Molecular Formula
C16H18O6
Molecular Mass
306.31
Other Names and Identifiers
InChI
InChI=1S/C16H18O6/c1-16(2,19)13-5-9-11(22-13)6-12-14(15(9)20-3)10(18)4-8(7-17)21-12/h4,6,13,17,19H,5,7H2,1-3H3/t13-/m0/s1
InChIKey
InChIKey=ATDBDSBKYKMRGZ-ZDUSSCGKSA-N
SMILES
O(C)C=1C2=C(C=C3C1C[C@@H](C(C)(C)O)O3)OC(CO)=CC2=O
Canonical SMILES
O=C1C=C(OC=2C=C3OC(CC3=C(OC)C12)C(O)(C)C)CO
Other Names for this Substance
- 5H-Furo[3,2-g][1]benzopyran-5-one, 2,3-dihydro-7-(hydroxymethyl)-2-(1-hydroxy-1-methylethyl)-4-methoxy-, (2S)-
- 5H-Furo[3,2-g][1]benzopyran-5-one, 2,3-dihydro-7-(hydroxymethyl)-2-(1-hydroxy-1-methylethyl)-4-methoxy-, (S)-
- (2S)-2,3-Dihydro-7-(hydroxymethyl)-2-(1-hydroxy-1-methylethyl)-4-methoxy-5H-furo[3,2-g][1]benzopyran-5-one
- Cimifugin
- Cimitin
- 2,3-Dihydro-7-hydroxymethyl-2-(1-hydroxy-1-methylethyl)-4-methoxy-5H-furo-[3,2-g]-[1]-benzopyran-5-one
- (2S)-7-(Hydroxymethyl)-2-(2-hydroxypropan-2-yl)-4-methoxy-2,3-dihydrofuro[3,2-g]chromen-5-one
