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Details

Stereochemistry ABSOLUTE
Molecular Formula C34H24O22
Molecular Weight 784.5412
Optical Activity UNSPECIFIED
Additional Stereochemistry Yes
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0
Stereo Comments AXIAL, R

SHOW SMILES / InChI
Structure of PLATYCARYANIN D

SMILES

O[C@@H]1COC(=O)C2=CC(O)=C(O)C(O)=C2C3=C(C=C(O)C(O)=C3O)C(=O)O[C@H]1[C@@H]4OC(=O)C5=CC(O)=C(O)C(O)=C5C6=C(O)C(O)=C(O)C=C6C(=O)O[C@H]4C=O

InChI

InChIKey=KHMBJGKOFANMAO-ALHZUIJYSA-N
InChI=1S/C34H24O22/c35-5-16-30(56-34(52)10-4-14(39)24(44)28(48)20(10)18-8(32(50)54-16)2-12(37)22(42)26(18)46)29-15(40)6-53-31(49)7-1-11(36)21(41)25(45)17(7)19-9(33(51)55-29)3-13(38)23(43)27(19)47/h1-5,15-16,29-30,36-48H,6H2/t15-,16+,29-,30-/m1/s1

HIDE SMILES / InChI

Molecular Formula C34H24O22
Molecular Weight 784.5412
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:15:42 GMT 2025
Edited
by admin
on Mon Mar 31 23:15:42 GMT 2025
Record UNII
8S667O756P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PLATYCARYANIN D
Common Name English
PEDUNCULAGIN, R-ISOMER
Preferred Name English
D-GLUCOSE, CYCLIC 2,3:4,6-BIS((1R)-4,4',5,5',6,6'-HEXAHYDROXY(1,1'-BIPHENYL)-2,2'-DICARBOXYLATE)
Systematic Name English
D-GLUCOSE, CYCLIC 2,3:4,6-BIS(4,4',5,5',6,6'-HEXAHYDROXY(1,1'-BIPHENYL)-2,2'-DICARBOXYLATE), (2(R),4(R))-
Systematic Name English
Code System Code Type Description
CAS
155073-98-6
Created by admin on Mon Mar 31 23:15:42 GMT 2025 , Edited by admin on Mon Mar 31 23:15:42 GMT 2025
PRIMARY
FDA UNII
8S667O756P
Created by admin on Mon Mar 31 23:15:42 GMT 2025 , Edited by admin on Mon Mar 31 23:15:42 GMT 2025
PRIMARY
PUBCHEM
15126804
Created by admin on Mon Mar 31 23:15:42 GMT 2025 , Edited by admin on Mon Mar 31 23:15:42 GMT 2025
PRIMARY