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

Details

Stereochemistry ABSOLUTE
Molecular Formula C14H18O8
Molecular Weight 314.2885
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VANILLOSIDE

SMILES

COc1cc(ccc1O[C@@]2([H])[C@@]([H])([C@]([H])([C@@]([H])([C@@]([H])(CO)O2)O)O)O)C=O

InChI

InChIKey=LPRNQMUKVDHCFX-RKQHYHRCSA-N
InChI=1S/C14H18O8/c1-20-9-4-7(5-15)2-3-8(9)21-14-13(19)12(18)11(17)10(6-16)22-14/h2-5,10-14,16-19H,6H2,1H3/t10-,11-,12+,13-,14-/m1/s1

HIDE SMILES / InChI

Molecular Formula C14H18O8
Molecular Weight 314.2885
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 Jun 26 08:46:01 UTC 2021
Edited
by admin
on Sat Jun 26 08:46:01 UTC 2021
Record UNII
H81U1KBS6E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VANILLOSIDE
Common Name English
VANILLIN-4-O-.BETA.-D-GLUCOPYRANOSIDE
Common Name English
4-(.BETA.-D-GLUCOPYRANOSYLOXY)-3-METHOXYBENZALDEHYDE
Common Name English
4-(BETA-D-GLUCOPYRANOSYLOXY)-3-METHOXY-BENZALDEHYDE
Systematic Name English
VANILLIN-D-GLUCOSIDE
Common Name English
GLUCOVANILLIN
MI  
Common Name English
AVENEIN
Common Name English
GLUCOVANILLIN [MI]
Common Name English
VANILLIN .BETA.-D-GLUCOPYRANOSIDE
Common Name English
VANILLIN-O-.BETA.-D-GLUCOPYRANOSIDE
Common Name English
VANILLIN GLUCOSIDE
Common Name English
BENZALDEHYDE, 4-(.BETA.-D-GLUCOPYRANOSYLOXY)-3-METHOXY-
Common Name English
Code System Code Type Description
PUBCHEM
6452133
Created by admin on Sat Jun 26 08:46:01 UTC 2021 , Edited by admin on Sat Jun 26 08:46:01 UTC 2021
PRIMARY
MESH
C443341
Created by admin on Sat Jun 26 08:46:01 UTC 2021 , Edited by admin on Sat Jun 26 08:46:01 UTC 2021
PRIMARY
EPA CompTox
494-08-6
Created by admin on Sat Jun 26 08:46:01 UTC 2021 , Edited by admin on Sat Jun 26 08:46:01 UTC 2021
PRIMARY
CAS
857657-29-5
Created by admin on Sat Jun 26 08:46:01 UTC 2021 , Edited by admin on Sat Jun 26 08:46:01 UTC 2021
SUPERSEDED
FDA UNII
H81U1KBS6E
Created by admin on Sat Jun 26 08:46:01 UTC 2021 , Edited by admin on Sat Jun 26 08:46:01 UTC 2021
PRIMARY
CAS
6049-95-2
Created by admin on Sat Jun 26 08:46:01 UTC 2021 , Edited by admin on Sat Jun 26 08:46:01 UTC 2021
SUPERSEDED
MERCK INDEX
M5770
Created by admin on Sat Jun 26 08:46:01 UTC 2021 , Edited by admin on Sat Jun 26 08:46:01 UTC 2021
PRIMARY Merck Index
CAS
494-08-6
Created by admin on Sat Jun 26 08:46:01 UTC 2021 , Edited by admin on Sat Jun 26 08:46:01 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT