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Details

Stereochemistry ABSOLUTE
Molecular Formula C30H34O6
Molecular Weight 490.5874
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,5,6-TRI-O-BENZYL-1,2-O-ISOPROPYLIDENE-ALPHA-D-GLUCOFURANOSE

SMILES

[H][C@]12O[C@]([H])([C@@H](COCC3=CC=CC=C3)OCC4=CC=CC=C4)[C@H](OCC5=CC=CC=C5)[C@@]1([H])OC(C)(C)O2

InChI

InChIKey=RNPMTPOOMRPILB-XYPQWYOHSA-N
InChI=1S/C30H34O6/c1-30(2)35-28-27(33-20-24-16-10-5-11-17-24)26(34-29(28)36-30)25(32-19-23-14-8-4-9-15-23)21-31-18-22-12-6-3-7-13-22/h3-17,25-29H,18-21H2,1-2H3/t25-,26-,27+,28-,29-/m1/s1

HIDE SMILES / InChI

Molecular Formula C30H34O6
Molecular Weight 490.5874
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 11:05:21 UTC 2023
Edited
by admin
on Sat Dec 16 11:05:21 UTC 2023
Record UNII
J63MA3RV3G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,5,6-TRI-O-BENZYL-1,2-O-ISOPROPYLIDENE-ALPHA-D-GLUCOFURANOSE
Common Name English
TRIBENOSIDE IMPURITY A [EP IMPURITY]
Common Name English
3,5,6-TRI-O-BENZYL-1,2-O-(1-METHYLETHYLIDENE)-.ALPHA.-D-GLUCOFURANOSE
Systematic Name English
1,2-O-ISOPROPYLIDENE-3,5,6-TRI-O-BENZYL-.ALPHA.-D-GLUCOFURANOSE
Systematic Name English
.ALPHA.-D-GLUCOFURANOSE, 1,2-O-(1-METHYLETHYLIDENE)-3,5,6-TRIS-O-(PHENYLMETHYL)-
Systematic Name English
Code System Code Type Description
CAS
53928-30-6
Created by admin on Sat Dec 16 11:05:21 UTC 2023 , Edited by admin on Sat Dec 16 11:05:21 UTC 2023
PRIMARY
ECHA (EC/EINECS)
258-868-3
Created by admin on Sat Dec 16 11:05:21 UTC 2023 , Edited by admin on Sat Dec 16 11:05:21 UTC 2023
PRIMARY
PUBCHEM
104646
Created by admin on Sat Dec 16 11:05:21 UTC 2023 , Edited by admin on Sat Dec 16 11:05:21 UTC 2023
PRIMARY
FDA UNII
J63MA3RV3G
Created by admin on Sat Dec 16 11:05:21 UTC 2023 , Edited by admin on Sat Dec 16 11:05:21 UTC 2023
PRIMARY
EPA CompTox
DTXSID30968720
Created by admin on Sat Dec 16 11:05:21 UTC 2023 , Edited by admin on Sat Dec 16 11:05:21 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP