U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C40H59NO11
Molecular Weight 729.8966
Optical Activity UNSPECIFIED
Defined Stereocenters 19 / 19
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ERIBULIN

SMILES

CO[C@H]1[C@@H](C[C@H](O)CN)O[C@H]2C[C@H]3O[C@H](C[C@@H](C)C3=C)CC[C@@H]4O[C@H](CC4=C)CC[C@@]56C[C@H]7O[C@@H]8[C@@H](O[C@H]9CC[C@H](CC(=O)C[C@H]12)O[C@@H]9[C@@H]8O5)[C@H]7O6

InChI

InChIKey=UFNVPOGXISZXJD-JBQZKEIOSA-N
InChI=1S/C40H59NO11/c1-19-11-24-5-7-28-20(2)12-26(45-28)9-10-40-17-33-36(51-40)37-38(50-33)39(52-40)35-29(49-37)8-6-25(47-35)13-22(42)14-27-31(16-30(46-24)21(19)3)48-32(34(27)44-4)15-23(43)18-41/h19,23-39,43H,2-3,5-18,41H2,1,4H3/t19-,23+,24+,25-,26+,27+,28+,29+,30-,31+,32-,33-,34-,35+,36+,37+,38-,39+,40+/m1/s1

HIDE SMILES / InChI

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
1.4 µM [IC50]
Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
Primary
HALAVEN
PubMed

PubMed

TitleDatePubMed
Novel second generation analogs of eribulin. Part III: Blood-brain barrier permeability and in vivo activity in a brain tumor model.
2011 Mar 15
Name Type Language
ERIBULIN
INN   MART.   MI   VANDF   WHO-DD  
INN  
Official Name English
ERIBULIN [VANDF]
Common Name English
ER-086526
Code English
ERIBULIN [INN]
Common Name English
ERIBULIN [WHO-DD]
Common Name English
ERIBULIN [MI]
Common Name English
ERIBULIN [MART.]
Common Name English
Classification Tree Code System Code
LIVERTOX 364
Created by admin on Tue Mar 06 17:07:25 UTC 2018 , Edited by admin on Tue Mar 06 17:07:25 UTC 2018
WHO-ATC L01XX41
Created by admin on Tue Mar 06 17:07:25 UTC 2018 , Edited by admin on Tue Mar 06 17:07:25 UTC 2018
WHO-VATC QL01XX41
Created by admin on Tue Mar 06 17:07:25 UTC 2018 , Edited by admin on Tue Mar 06 17:07:25 UTC 2018
EMA ASSESSMENT REPORTS HALAVEN (AUTHORIZED: BREAST NEOLPLASMA)
Created by admin on Tue Mar 06 17:07:25 UTC 2018 , Edited by admin on Tue Mar 06 17:07:25 UTC 2018
Code System Code Type Description
WIKIPEDIA
ERIBULIN
Created by admin on Tue Mar 06 17:07:25 UTC 2018 , Edited by admin on Tue Mar 06 17:07:25 UTC 2018
PRIMARY
IUPHAR
6813
Created by admin on Tue Mar 06 17:07:25 UTC 2018 , Edited by admin on Tue Mar 06 17:07:25 UTC 2018
PRIMARY
PUBCHEM
11354606
Created by admin on Tue Mar 06 17:07:25 UTC 2018 , Edited by admin on Tue Mar 06 17:07:25 UTC 2018
PRIMARY SWITZERF
RXCUI
1045453
Created by admin on Tue Mar 06 17:07:25 UTC 2018 , Edited by admin on Tue Mar 06 17:07:25 UTC 2018
PRIMARY RxNorm
ChEMBL
CHEMBL1683590
Created by admin on Tue Mar 06 17:07:25 UTC 2018 , Edited by admin on Tue Mar 06 17:07:25 UTC 2018
PRIMARY
INN
8854
Created by admin on Tue Mar 06 17:07:25 UTC 2018 , Edited by admin on Tue Mar 06 17:07:25 UTC 2018
PRIMARY
CAS
253128-41-5
Created by admin on Tue Mar 06 17:07:25 UTC 2018 , Edited by admin on Tue Mar 06 17:07:25 UTC 2018
PRIMARY
EVMPD
SUB31134
Created by admin on Tue Mar 06 17:07:25 UTC 2018 , Edited by admin on Tue Mar 06 17:07:25 UTC 2018
PRIMARY
MESH
C490954
Created by admin on Tue Mar 06 17:07:25 UTC 2018 , Edited by admin on Tue Mar 06 17:07:25 UTC 2018
PRIMARY
MERCK INDEX
M4993
Created by admin on Tue Mar 06 17:07:25 UTC 2018 , Edited by admin on Tue Mar 06 17:07:25 UTC 2018
PRIMARY Merck Index
NCI_THESAURUS
C96748
Created by admin on Tue Mar 06 17:07:25 UTC 2018 , Edited by admin on Tue Mar 06 17:07:25 UTC 2018
PRIMARY
DRUG BANK
DB08871
Created by admin on Tue Mar 06 17:07:25 UTC 2018 , Edited by admin on Tue Mar 06 17:07:25 UTC 2018
PRIMARY