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Details

Stereochemistry ABSOLUTE
Molecular Formula C32H36BrN5O8
Molecular Weight 698.561
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PIBROZELESIN

SMILES

COC(=O)C1=C(C)NC2=C1C3=C(C=C2OC(=O)N4CCN(C)CC4)N(C[C@H]3CBr)C(=O)C5=CC6=C(N5)C(OC)=C(OC)C(OC)=C6

InChI

InChIKey=QRMNENFZDDYDEF-GOSISDBHSA-N
InChI=1S/C32H36BrN5O8/c1-16-23(31(40)45-6)25-24-18(14-33)15-38(20(24)13-21(27(25)34-16)46-32(41)37-9-7-36(2)8-10-37)30(39)19-11-17-12-22(42-3)28(43-4)29(44-5)26(17)35-19/h11-13,18,34-35H,7-10,14-15H2,1-6H3/t18-/m1/s1

HIDE SMILES / InChI

Molecular Formula C32H36BrN5O8
Molecular Weight 698.561
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 17:43:50 UTC 2023
Edited
by admin
on Sat Dec 16 17:43:50 UTC 2023
Record UNII
IHK933KCIC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PIBROZELESIN
INN   WHO-DD  
INN  
Official Name English
pibrozelesin [INN]
Common Name English
Pibrozelesin [WHO-DD]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C2156
Created by admin on Sat Dec 16 17:43:50 UTC 2023 , Edited by admin on Sat Dec 16 17:43:50 UTC 2023
Code System Code Type Description
INN
7890
Created by admin on Sat Dec 16 17:43:50 UTC 2023 , Edited by admin on Sat Dec 16 17:43:50 UTC 2023
PRIMARY
NCI_THESAURUS
C1542
Created by admin on Sat Dec 16 17:43:50 UTC 2023 , Edited by admin on Sat Dec 16 17:43:50 UTC 2023
PRIMARY
SMS_ID
300000036948
Created by admin on Sat Dec 16 17:43:50 UTC 2023 , Edited by admin on Sat Dec 16 17:43:50 UTC 2023
PRIMARY
PUBCHEM
132979
Created by admin on Sat Dec 16 17:43:50 UTC 2023 , Edited by admin on Sat Dec 16 17:43:50 UTC 2023
PRIMARY
FDA UNII
IHK933KCIC
Created by admin on Sat Dec 16 17:43:50 UTC 2023 , Edited by admin on Sat Dec 16 17:43:50 UTC 2023
PRIMARY
ChEMBL
CHEMBL36015
Created by admin on Sat Dec 16 17:43:50 UTC 2023 , Edited by admin on Sat Dec 16 17:43:50 UTC 2023
PRIMARY
CAS
154889-68-6
Created by admin on Sat Dec 16 17:43:50 UTC 2023 , Edited by admin on Sat Dec 16 17:43:50 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> DERIVATIVE
SALT/SOLVATE -> PARENT