SpectraBase Spectrum ID |
A5Ec7Pu2GgE |
Name |
Acumitin [1,3-Dihydroxy-2-[(2-hydroxyphenyl)methyl]-9H-xanthen-9-one-4-yl]-3-phenyl-1-propanone] |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C29H22O6 |
InChI |
InChI=1S/C29H22O6/c30-21-12-6-4-10-18(21)16-20-27(33)24(22(31)15-14-17-8-2-1-3-9-17)29-25(28(20)34)26(32)19-11-5-7-13-23(19)35-29/h1-13,30,33-34H,14-16H2 |
InChIKey |
NIFSYUFGZVWGGD-UHFFFAOYSA-N |
Molecular Weight |
466.489 g/mol |
SMILES |
Oc1c(c(c2c(c1C(=O)CCc1ccccc1)Oc1ccccc1C2=O)O)Cc1c(O)cccc1 |
SPLASH |
splash10-014i-1091400000-34c84b1db6d01cad8a01 |
Source of Spectrum |
E2-52-140-2 |
Synonyms |
1,3-Dihydroxy-2-[(2-hydroxyphenyl)methyl]-4-(1-oxo-3-phenylpropyl)-9-xanthenone
1,3-Dihydroxy-2-[(2-hydroxyphenyl)methyl]-4-(3-phenylpropanoyl)xanthen-9-one
2-[(2-hydroxyphenyl)methyl]-1,3-bis(oxidanyl)-4-(3-phenylpropanoyl)xanthen-9-one |
Wiley ID |
1556382 |