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Details

Stereochemistry ABSOLUTE
Molecular Formula C42H46O11
Molecular Weight 726.808
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of PARADISIN A

SMILES

C\C(CC[C@@H](O)C(C)(C)O[C@H](CC\C(C)=C\COC1=C2C=CC(=O)OC2=CC3=C1C=CO3)C(C)(C)O)=C/COC4=C5C=COC5=CC6=C4C=CC(=O)O6

InChI

InChIKey=AGWWNHLHAZTYCS-OBKSYJDZSA-N
InChI=1S/C42H46O11/c1-25(15-19-49-39-27-9-13-37(44)51-33(27)23-31-29(39)17-21-47-31)7-11-35(43)42(5,6)53-36(41(3,4)46)12-8-26(2)16-20-50-40-28-10-14-38(45)52-34(28)24-32-30(40)18-22-48-32/h9-10,13-18,21-24,35-36,43,46H,7-8,11-12,19-20H2,1-6H3/b25-15+,26-16+/t35-,36-/m1/s1

HIDE SMILES / InChI

Molecular Formula C42H46O11
Molecular Weight 726.808
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 2
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 18:30:40 GMT 2025
Edited
by admin
on Mon Mar 31 18:30:40 GMT 2025
Record UNII
G7D7846X1N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PARADISIN A
Common Name English
FC-726
Preferred Name English
7H-FURO(3,2-G)(1)BENZOPYRAN-7-ONE, 4-(((2E,6R)-6-HYDROXY-7-(((1R,4E)-1-(1-HYDROXY-1-METHYLETHYL)-4-METHYL-6-((7-OXO-7H-FURO(3,2-G)(1)BENZOPYRAN-4-YL)OXY)-4-HEXEN-1-YL)OXY)-3,7-DIMETHYL-2-OCTEN-1-YL)OXY)-
Systematic Name English
Code System Code Type Description
FDA UNII
G7D7846X1N
Created by admin on Mon Mar 31 18:30:40 GMT 2025 , Edited by admin on Mon Mar 31 18:30:40 GMT 2025
PRIMARY
PUBCHEM
72941753
Created by admin on Mon Mar 31 18:30:40 GMT 2025 , Edited by admin on Mon Mar 31 18:30:40 GMT 2025
PRIMARY
CAS
198343-05-4
Created by admin on Mon Mar 31 18:30:40 GMT 2025 , Edited by admin on Mon Mar 31 18:30:40 GMT 2025
PRIMARY