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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H18O11
Molecular Weight 446.361
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GLYCHIONIDE A

SMILES

O[C@H]1[C@H](OC2=C(O)C3=C(C(=O)C=C(O3)C4=CC=CC=C4)C(O)=C2)O[C@@H]([C@@H](O)[C@@H]1O)C(O)=O

InChI

InChIKey=MOFOLNOWFPVLGZ-BHWDSYMASA-N
InChI=1S/C21H18O11/c22-9-6-11(8-4-2-1-3-5-8)30-18-13(9)10(23)7-12(14(18)24)31-21-17(27)15(25)16(26)19(32-21)20(28)29/h1-7,15-17,19,21,23-27H,(H,28,29)/t15-,16-,17+,19-,21+/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H18O11
Molecular Weight 446.361
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:28:27 UTC 2023
Edited
by admin
on Sat Dec 16 09:28:27 UTC 2023
Record UNII
58792ZUT0H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GLYCHIONIDE A
Common Name English
.BETA.-D-GLUCOPYRANOSIDURONIC ACID, 5,8-DIHYDROXY-4-OXO-2-PHENYL-4H-1-BENZOPYRAN-7-YL
Systematic Name English
Code System Code Type Description
PUBCHEM
11597485
Created by admin on Sat Dec 16 09:28:27 UTC 2023 , Edited by admin on Sat Dec 16 09:28:27 UTC 2023
PRIMARY
FDA UNII
58792ZUT0H
Created by admin on Sat Dec 16 09:28:27 UTC 2023 , Edited by admin on Sat Dec 16 09:28:27 UTC 2023
PRIMARY
CAS
119152-50-0
Created by admin on Sat Dec 16 09:28:27 UTC 2023 , Edited by admin on Sat Dec 16 09:28:27 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT