U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C27H30O16
Molecular Weight 610.5175
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PEONOSIDE

SMILES

OC[C@H]1O[C@@H](OC2=CC3=C(C(=O)C(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)=C(O3)C5=CC=C(O)C=C5)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O

InChI

InChIKey=XFFQVRFGLSBFON-DEFKTLOSSA-N
InChI=1S/C27H30O16/c28-7-14-17(32)20(35)22(37)26(41-14)39-11-5-12(31)16-13(6-11)40-24(9-1-3-10(30)4-2-9)25(19(16)34)43-27-23(38)21(36)18(33)15(8-29)42-27/h1-6,14-15,17-18,20-23,26-33,35-38H,7-8H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1

HIDE SMILES / InChI

Molecular Formula C27H30O16
Molecular Weight 610.5175
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 10 / 10
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:24:27 GMT 2023
Edited
by admin
on Sat Dec 16 09:24:27 GMT 2023
Record UNII
1SL009I82F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PEONOSIDE
Common Name English
PAEONOSIDE
Common Name English
KAEMPFEROL-3-O-.BETA.-D-GLUCOSYL-7-O-.BETA.-D-GLUCOSIDE
Common Name English
KAEMPFEROL 3,7-DI-O-GLUCOSIDE
Common Name English
GLUCOPYRANOSIDE, KAEMPFEROL-3,7 DI-, .BETA.-D-
Common Name English
4H-1-BENZOPYRAN-4-ONE, 3,7-BIS(.BETA.-D-GLUCOPYRANOSYLOXY)-5-HYDROXY-2-(4-HYDROXYPHENYL)-
Common Name English
KAEMPFEROL 3,7-DI-O-.BETA.-D-GLUCOPYRANOSIDE
Common Name English
KAEMPFEROL 3,7-DI-.BETA.-D-GLUCOPYRANOSIDE
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID601311270
Created by admin on Sat Dec 16 09:24:27 GMT 2023 , Edited by admin on Sat Dec 16 09:24:27 GMT 2023
PRIMARY
CAS
25615-14-9
Created by admin on Sat Dec 16 09:24:27 GMT 2023 , Edited by admin on Sat Dec 16 09:24:27 GMT 2023
PRIMARY
PUBCHEM
6325460
Created by admin on Sat Dec 16 09:24:27 GMT 2023 , Edited by admin on Sat Dec 16 09:24:27 GMT 2023
PRIMARY
CHEBI
133224
Created by admin on Sat Dec 16 09:24:27 GMT 2023 , Edited by admin on Sat Dec 16 09:24:27 GMT 2023
PRIMARY
FDA UNII
1SL009I82F
Created by admin on Sat Dec 16 09:24:27 GMT 2023 , Edited by admin on Sat Dec 16 09:24:27 GMT 2023
PRIMARY