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Details

Stereochemistry ABSOLUTE
Molecular Formula C43H78N6O13
Molecular Weight 887.1118
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ROMURTIDE

SMILES

[H][C@](O[C@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](CCC(=O)N[C@@H](CCCCNC(=O)CCCCCCCCCCCCCCCCC)C(O)=O)C(N)=O)([C@H](O)[C@H](O)CO)[C@@H](NC(C)=O)C=O

InChI

InChIKey=IKSJCVFYCIKDTB-GZZWOGMVSA-N
InChI=1S/C43H78N6O13/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-36(54)45-26-21-20-22-33(43(60)61)48-37(55)25-24-32(40(44)57)49-41(58)29(2)46-42(59)30(3)62-39(38(56)35(53)28-51)34(27-50)47-31(4)52/h27,29-30,32-35,38-39,51,53,56H,5-26,28H2,1-4H3,(H2,44,57)(H,45,54)(H,46,59)(H,47,52)(H,48,55)(H,49,58)(H,60,61)/t29-,30+,32+,33-,34-,35+,38+,39+/m0/s1

HIDE SMILES / InChI

Molecular Formula C43H78N6O13
Molecular Weight 887.1118
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:04:44 UTC 2023
Edited
by admin
on Fri Dec 15 16:04:44 UTC 2023
Record UNII
SUP956TPT6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ROMURTIDE
INN   JAN   MI   WHO-DD  
INN  
Official Name English
2-ACETAMIDO-3-O-((R)-1-(((S)-1-(((R)-1-CARBAMOYL-3-(((S)-1-CARBOXY-5-STEARAMIDOPENTYL)CARBAMOYL)PROPYL)CARBAMOYL)ETHYL)CARBAMOYL)ETHYL)-2-DEOXY-D-GLUCOPYRANOSE
Common Name English
ROMURTIDE [JAN]
Common Name English
NOPIA
Brand Name English
romurtide [INN]
Common Name English
Romurtide [WHO-DD]
Common Name English
ROMURTIDE [MI]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C201
Created by admin on Fri Dec 15 16:04:44 UTC 2023 , Edited by admin on Fri Dec 15 16:04:44 UTC 2023
Code System Code Type Description
MESH
C036866
Created by admin on Fri Dec 15 16:04:44 UTC 2023 , Edited by admin on Fri Dec 15 16:04:44 UTC 2023
PRIMARY
PUBCHEM
9940969
Created by admin on Fri Dec 15 16:04:44 UTC 2023 , Edited by admin on Fri Dec 15 16:04:44 UTC 2023
PRIMARY
FDA UNII
SUP956TPT6
Created by admin on Fri Dec 15 16:04:44 UTC 2023 , Edited by admin on Fri Dec 15 16:04:44 UTC 2023
PRIMARY
EPA CompTox
DTXSID401318575
Created by admin on Fri Dec 15 16:04:44 UTC 2023 , Edited by admin on Fri Dec 15 16:04:44 UTC 2023
PRIMARY
DRUG CENTRAL
2400
Created by admin on Fri Dec 15 16:04:44 UTC 2023 , Edited by admin on Fri Dec 15 16:04:44 UTC 2023
PRIMARY
MERCK INDEX
m9654
Created by admin on Fri Dec 15 16:04:44 UTC 2023 , Edited by admin on Fri Dec 15 16:04:44 UTC 2023
PRIMARY Merck Index
SMS_ID
100000084356
Created by admin on Fri Dec 15 16:04:44 UTC 2023 , Edited by admin on Fri Dec 15 16:04:44 UTC 2023
PRIMARY
INN
6406
Created by admin on Fri Dec 15 16:04:44 UTC 2023 , Edited by admin on Fri Dec 15 16:04:44 UTC 2023
PRIMARY
EVMPD
SUB10375MIG
Created by admin on Fri Dec 15 16:04:44 UTC 2023 , Edited by admin on Fri Dec 15 16:04:44 UTC 2023
PRIMARY
CAS
78113-36-7
Created by admin on Fri Dec 15 16:04:44 UTC 2023 , Edited by admin on Fri Dec 15 16:04:44 UTC 2023
PRIMARY
NCI_THESAURUS
C152247
Created by admin on Fri Dec 15 16:04:44 UTC 2023 , Edited by admin on Fri Dec 15 16:04:44 UTC 2023
PRIMARY
ChEMBL
CHEMBL1908331
Created by admin on Fri Dec 15 16:04:44 UTC 2023 , Edited by admin on Fri Dec 15 16:04:44 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> AGONIST
Related Record Type Details
ACTIVE MOIETY