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Details

Stereochemistry ABSOLUTE
Molecular Formula C48H67N13O11
Molecular Weight 1002.1261
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ARFALASIN

SMILES

CC(C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)CCC(N)=O)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC2=CNC=N2)C(=O)N3CCC[C@H]3C(=O)N[C@H](C(O)=O)C4=CC=CC=C4

InChI

InChIKey=IBGNPQRJAXAGJH-MBNHCIONSA-N
InChI=1S/C48H67N13O11/c1-26(2)38(58-41(65)32(12-8-20-53-48(50)51)55-37(64)19-18-36(49)63)44(68)56-33(22-28-14-16-31(62)17-15-28)42(66)59-39(27(3)4)45(69)57-34(23-30-24-52-25-54-30)46(70)61-21-9-13-35(61)43(67)60-40(47(71)72)29-10-6-5-7-11-29/h5-7,10-11,14-17,24-27,32-35,38-40,62H,8-9,12-13,18-23H2,1-4H3,(H2,49,63)(H,52,54)(H,55,64)(H,56,68)(H,57,69)(H,58,65)(H,59,66)(H,60,67)(H,71,72)(H4,50,51,53)/t32-,33-,34-,35-,38-,39-,40-/m0/s1

HIDE SMILES / InChI

Molecular Formula C48H67N13O11
Molecular Weight 1002.1261
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Arfalasin or Hoe 409, an angiotensin II (AII) blocker, inhibits the renin release thus delay recovery of urinary osmolality.

Approval Year

PubMed

PubMed

TitleDatePubMed
Is the renin-angiotensin system involved in urinary concentration mechanisms?
1984
Substance Class Chemical
Created
by admin
on Fri Dec 15 16:07:27 GMT 2023
Edited
by admin
on Fri Dec 15 16:07:27 GMT 2023
Record UNII
7E6SP93I57
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ARFALASIN
INN  
INN  
Official Name English
arfalasin [INN]
Common Name English
1-SUCCINAMIC ACID-5-L-VALINE-8-(L-2-PHENYLGLYCINE)ANGIOTENSIN II
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C66930
Created by admin on Fri Dec 15 16:07:27 GMT 2023 , Edited by admin on Fri Dec 15 16:07:27 GMT 2023
Code System Code Type Description
NCI_THESAURUS
C87430
Created by admin on Fri Dec 15 16:07:27 GMT 2023 , Edited by admin on Fri Dec 15 16:07:27 GMT 2023
PRIMARY
ChEMBL
CHEMBL2218920
Created by admin on Fri Dec 15 16:07:27 GMT 2023 , Edited by admin on Fri Dec 15 16:07:27 GMT 2023
PRIMARY
MESH
C046068
Created by admin on Fri Dec 15 16:07:27 GMT 2023 , Edited by admin on Fri Dec 15 16:07:27 GMT 2023
PRIMARY
EPA CompTox
DTXSID401024241
Created by admin on Fri Dec 15 16:07:27 GMT 2023 , Edited by admin on Fri Dec 15 16:07:27 GMT 2023
PRIMARY
CAS
60173-73-1
Created by admin on Fri Dec 15 16:07:27 GMT 2023 , Edited by admin on Fri Dec 15 16:07:27 GMT 2023
PRIMARY
EVMPD
SUB05557MIG
Created by admin on Fri Dec 15 16:07:27 GMT 2023 , Edited by admin on Fri Dec 15 16:07:27 GMT 2023
PRIMARY
PUBCHEM
15171759
Created by admin on Fri Dec 15 16:07:27 GMT 2023 , Edited by admin on Fri Dec 15 16:07:27 GMT 2023
PRIMARY
FDA UNII
7E6SP93I57
Created by admin on Fri Dec 15 16:07:27 GMT 2023 , Edited by admin on Fri Dec 15 16:07:27 GMT 2023
PRIMARY
SMS_ID
100000087169
Created by admin on Fri Dec 15 16:07:27 GMT 2023 , Edited by admin on Fri Dec 15 16:07:27 GMT 2023
PRIMARY
INN
4141
Created by admin on Fri Dec 15 16:07:27 GMT 2023 , Edited by admin on Fri Dec 15 16:07:27 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY