| SpectraBase Spectrum ID |
GQja9tFjBQ0 |
| Name |
panduratin B |
| Alternate Name(s) |
panduratin B/1
(2RS,1''RS,2''SR,6''RS)-[7-hydroxy-5-methoxy-2-methyl-2-(4'-methylpent-3'-enyl)-2H-chromen-8-yl]-[3''-methyl-2''-(3''-mehylbut-2''-enyl)-6''-phenylcyclohex-3''-enyl]methanone
panduratin B/2
(2RS,1''SR,2''RS,6''SR)-[7-hydroxy-5-methoxy-2-methyl-2-(4'-methylpent-3'-enyl)-2H-chromen-8-yl]-[3''-methyl-2''-(3''-mehylbut-2''-enyl)-6''-phenylcyclohex-3''-enyl]methanone
[7-hydroxy-5-methoxy-2-methyl-2-(4'-methylpent-3'-enyl)-2H-chromen-8-yl]-[3''-methyl-2''-(3''-mehylbut-2''-enyl)-6''-phenylcyclohex-3''-enyl]methanone
[7-hydroxy-5-methoxy-2-methyl-2-(4-methyl-3-pentenyl)-2H-chromen-8-yl][3-methyl-2-(3-methyl-2-butenyl)-6-phenyl-3-cyclohexen-1-yl]methanone |
| CAS Registry Number |
109905-45-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C36H44O4 |
| InChI |
InChI=1S/C36H44O4/c1-23(2)12-11-20-36(6)21-19-29-31(39-7)22-30(37)33(35(29)40-36)34(38)32-27(17-15-24(3)4)25(5)16-18-28(32)26-13-9-8-10-14-26/h8-10,12-16,19,21-22,27-28,32,37H,11,17-18,20H2,1-7H3 |
| InChIKey |
TVOAGJMMOUCDTK-UHFFFAOYSA-N |
| Molecular Weight |
540.744 g/mol |
| SMILES |
Oc1c(c2c(C=CC(O2)(CCC=C(C)C)C)c(c1)OC)C(C1C(C(C)=CCC1c1ccccc1)CC=C(C)C)=O |
| SPLASH |
splash10-0aor-5353910000-14d83f041cf756925d0a |
| Source of Spectrum |
B-40-459-4 |
| Wiley ID |
1404702 |
