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Details

Stereochemistry ABSOLUTE
Molecular Formula C29H43NO9
Molecular Weight 549.653
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HO-PEG5-NALOXOL

SMILES

[H][C@@]12OC3=C(O)C=CC4=C3[C@@]15CCN(CC=C)[C@H](C4)[C@]5(O)CC[C@@H]2OCCOCCOCCOCCOCCO

InChI

InChIKey=VCZROMAAUMDCHE-BTEQVPEFSA-N
InChI=1S/C29H43NO9/c1-2-8-30-9-7-28-25-21-3-4-22(32)26(25)39-27(28)23(5-6-29(28,33)24(30)20-21)38-19-18-37-17-16-36-15-14-35-13-12-34-11-10-31/h2-4,23-24,27,31-33H,1,5-20H2/t23-,24+,27-,28-,29+/m0/s1

HIDE SMILES / InChI

Molecular Formula C29H43NO9
Molecular Weight 549.653
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 Thu Jul 06 20:49:20 UTC 2023
Edited
by admin
on Thu Jul 06 20:49:20 UTC 2023
Record UNII
UN8DF3ZPX5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HO-PEG5-NALOXOL
Common Name English
MORPHINAN-3,14-DIOL, 4,5-EPOXY-6-((14-HYDROXY-3,6,9,12-TETRAOXATETRADEC-1-YL)OXY)-17-(2-PROPEN-1-YL)-, (5.ALPHA.,6.ALPHA.)-
Systematic Name English
NALOXEGOL METABOLITE M7
Common Name English
Code System Code Type Description
FDA UNII
UN8DF3ZPX5
Created by admin on Thu Jul 06 20:49:21 UTC 2023 , Edited by admin on Thu Jul 06 20:49:21 UTC 2023
PRIMARY
CAS
2194602-15-6
Created by admin on Thu Jul 06 20:49:21 UTC 2023 , Edited by admin on Thu Jul 06 20:49:21 UTC 2023
PRIMARY
PUBCHEM
156596399
Created by admin on Thu Jul 06 20:49:21 UTC 2023 , Edited by admin on Thu Jul 06 20:49:21 UTC 2023
PRIMARY
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