Basic Searches
Searches without any special characters (listed below) will return items that contain the exact value(s) entered in the search field. This means that searching for "ASPIRIN CALCIUM" won't return any items that have "ASPIRIN GLYCINE CALCIUM" because the search term doesn't match exactly.
Boolean Operators
OR - searches with terms separated by " OR " will return items that contain any of the terms in the search.
Example: "ASPIRIN" OR "CALCIUM" will return items that have strings like "ASPIRIN GLYCINE" and "GLYCINE CALCIUM" because they contain at least one of the terms in the search.

AND - searches with terms separated by " AND " will return items that contain all the terms in the search.
Example: "ASPIRIN" AND "CALCIUM" won't return items that have strings "ASPIRIN GLYCINE" and "GLYCINE CALCIUM" because neither contain both terms, but it will return "ASPIRIN GLYCINE CALCIUM" because it contains both search terms.
version 2.7.1
Substance Class Chemical
Record UNII
BKT5F9C2NI
Record Status Validated
Record Version
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Details

Stereochemistry ABSOLUTE
Molecular Formula C30H33ClN4O2
Molecular Weight 517.062
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0
Created by admin on Sat Jun 26 04:58:22 EDT 2021
Edited by GUEST on Wed Jul 21 16:07:35 EDT 2021
Structure of ISPINESIB

Systematic Names:

  • None recorded

SMILES

CC(C)[C@@H](N(CCCN)C(=O)C1=CC=C(C)C=C1)C2=NC3=CC(Cl)=CC=C3C(=O)N2CC4=CC=CC=C4

InChI

QJZRFPJCWMNVAV-HHHXNRCGSA-N
InChI=1S/C30H33ClN4O2/c1-20(2)27(34(17-7-16-32)29(36)23-12-10-21(3)11-13-23)28-33-26-18-24(31)14-15-25(26)30(37)35(28)19-22-8-5-4-6-9-22/h4-6,8-15,18,20,27H,7,16-17,19,32H2,1-3H3/t27-/m1/s1
Name Type Language Details Access References
ISPINESIB
Domain Jurisdiction Naming Organization
drug  
INN  
INN   WHO-DD  
Official Name
English  
ISPINESIB [WHO-DD]
Common Name
English  
ISPINESIB [INN]
Common Name
English  
Classification Tree Code System Code Access References
NCI_THESAURUS C67440
Created by admin on Sat Jun 26 04:58:22 EDT 2021 , Edited by admin on Sat Jun 26 04:58:22 EDT 2021
Code System Code Type Description Access References
CAS
336113-53-2
Created by admin on Sat Jun 26 04:58:22 EDT 2021 , Edited by admin on Sat Jun 26 04:58:22 EDT 2021
PRIMARY
EVMPD
SUB33489
Created by admin on Sat Jun 26 04:58:22 EDT 2021 , Edited by admin on Sat Jun 26 04:58:22 EDT 2021
PRIMARY
ChEMBL
CHEMBL2111096
Created by admin on Sat Jun 26 04:58:22 EDT 2021 , Edited by admin on Sat Jun 26 04:58:22 EDT 2021
PRIMARY
DRUG BANK
DB06188
Created by admin on Sat Jun 26 04:58:22 EDT 2021 , Edited by admin on Sat Jun 26 04:58:22 EDT 2021
PRIMARY
EPA CompTox
336113-53-2
Created by admin on Sat Jun 26 04:58:22 EDT 2021 , Edited by admin on Sat Jun 26 04:58:22 EDT 2021
PRIMARY
FDA UNII
BKT5F9C2NI
Created by admin on Sat Jun 26 04:58:22 EDT 2021 , Edited by admin on Sat Jun 26 04:58:22 EDT 2021
PRIMARY
INN
8570
Created by admin on Sat Jun 26 04:58:22 EDT 2021 , Edited by admin on Sat Jun 26 04:58:22 EDT 2021
PRIMARY
MESH
C508757
Created by admin on Sat Jun 26 04:58:22 EDT 2021 , Edited by admin on Sat Jun 26 04:58:22 EDT 2021
PRIMARY
NCI_THESAURUS
C38131
Created by admin on Sat Jun 26 04:58:22 EDT 2021 , Edited by admin on Sat Jun 26 04:58:22 EDT 2021
PRIMARY
PUBCHEM
6851740
Created by admin on Sat Jun 26 04:58:22 EDT 2021 , Edited by admin on Sat Jun 26 04:58:22 EDT 2021
PRIMARY
Related Record Type Details Access References
SALT/SOLVATE -> PARENT
none
none
Mediator Substance Details
none
Created by admin on Sat Jun 26 04:58:22 EDT 2021 , Edited by admin on Sat Jun 26 04:58:22 EDT 2021
TARGET -> INHIBITOR
Mediator Substance Details
none
IC50
Created by admin on Sat Jun 26 04:58:22 EDT 2021 , Edited by admin on Sat Jun 26 04:58:22 EDT 2021
Related Record Type Details Access References
ACTIVE MOIETY
none
none
Mediator Substance Details
none
Created by admin on Sat Jun 26 04:58:22 EDT 2021 , Edited by admin on Sat Jun 26 04:58:22 EDT 2021
Created Sat Jun 26 04:58:22 EDT 2021
Created By admin
Last Edited Sat Jun 26 04:58:22 EDT 2021
Last Edited By admin
Index Source Text / Citation Source Type Tags Date Accessed File Access
1 STN STN (SCIFINDER)
2 WEBSITE WEBSITE NOMEN PUBLIC_DOMAIN_RELEASE
3 SRS CODE IMPORT SRS NOMEN Fri Apr 28 14:45:31 EDT 2017
4 dump-public-2021-06-23_UPDATED.gsrs BATCH_IMPORT Sat Jun 26 04:58:21 EDT 2021
5 INN Proposed List 92 INN_LIST PUBLIC_DOMAIN_RELEASE
6 ISPINESIB [WHO-DD] SRS_LOCATOR
7 USP DICTIONARY 2008 SRS NOMEN PUBLIC_DOMAIN_RELEASE AUTO_SELECTED
8 ISPINESIB [INN] SRS_LOCATOR
9 Nyamaa, Bayalagmaa, et al. "Kinesin Spindle Protein Inhibition in Translational Research." Journal of Lipid and Atherosclerosis 3.2 (2014): 63-78. JA PUBLIC_DOMAIN_RELEASE
10 WHO-DD SRS NOMEN
11 SYSTEM
12 WHO DRUG DICTIONARY WHO DRUG DICTIONARY NOMEN
13 SRS import [BKT5F9C2NI] SRS NOMEN Fri Apr 28 14:45:31 EDT 2017

Molecular Formula C30H33ClN4O2
Molecular Weight 517.062
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED