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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H38O19P4
Molecular Weight 682.378
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of INO-4913

SMILES

CCCCCCCCO[C@@H]1[C@H](OC(=O)CCC)[C@H](OP(O)(O)=O)[C@@H](OP(O)(O)=O)[C@H](OP(O)(O)=O)[C@H]1OP(O)(O)=O

InChI

InChIKey=BSDQDNAUSZHJKS-OIGKAMSRSA-N
InChI=1S/C18H38O19P4/c1-3-5-6-7-8-9-11-32-13-14(33-12(19)10-4-2)16(35-39(23,24)25)18(37-41(29,30)31)17(36-40(26,27)28)15(13)34-38(20,21)22/h13-18H,3-11H2,1-2H3,(H2,20,21,22)(H2,23,24,25)(H2,26,27,28)(H2,29,30,31)/t13-,14+,15+,16+,17-,18-/m1/s1

HIDE SMILES / InChI

Molecular Formula C18H38O19P4
Molecular Weight 682.378
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 21:07:56 GMT 2025
Edited
by admin
on Mon Mar 31 21:07:56 GMT 2025
Record UNII
F1WO9LF50E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-O-BUTYRYL-1-O-OCTYL-MYO-INOSITOL 3,4,5,6-TETRAKISPHOSPHATE
Preferred Name English
INO-4913
Common Name English
Code System Code Type Description
FDA UNII
F1WO9LF50E
Created by admin on Mon Mar 31 21:07:56 GMT 2025 , Edited by admin on Mon Mar 31 21:07:56 GMT 2025
PRIMARY
PUBCHEM
76967900
Created by admin on Mon Mar 31 21:07:56 GMT 2025 , Edited by admin on Mon Mar 31 21:07:56 GMT 2025
PRIMARY
Related Record Type Details
ACTIVE MOIETY