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Details

Stereochemistry ABSOLUTE
Molecular Formula C45H54F2N4O8
Molecular Weight 816.9291
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VINFLUNINE

SMILES

[H][C@@]12N3CC[C@@]14C5=C(C=C(OC)C(=C5)[C@]6(C[C@@H]7C[C@H](C[N@@](C7)CC8=C6NC9=C8C=CC=C9)C(C)(F)F)C(=O)OC)N(C)[C@@]4([H])[C@](O)([C@H](OC(C)=O)[C@]2(CC)C=CC3)C(=O)OC

InChI

InChIKey=NMDYYWFGPIMTKO-KLCPSUAYSA-N
InChI=1S/C45H54F2N4O8/c1-8-42-14-11-16-51-17-15-43(36(42)51)30-19-31(34(56-5)20-33(30)49(4)37(43)45(55,40(54)58-7)38(42)59-25(2)52)44(39(53)57-6)21-26-18-27(41(3,46)47)23-50(22-26)24-29-28-12-9-10-13-32(28)48-35(29)44/h9-14,19-20,26-27,36-38,48,55H,8,15-18,21-24H2,1-7H3/t26-,27+,36-,37+,38+,42+,43+,44-,45-/m0/s1

HIDE SMILES / InChI

Molecular Formula C45H54F2N4O8
Molecular Weight 816.9291
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 17:40:39 UTC 2023
Edited
by admin
on Sat Dec 16 17:40:39 UTC 2023
Record UNII
5BF646324K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VINFLUNINE
EMA EPAR   INN   MART.   MI   WHO-DD  
INN  
Official Name English
VINFLUNINE [MI]
Common Name English
VINFLUNINE [EMA EPAR]
Common Name English
4'-DEOXY-20',20'-DIFLUORO-8'-NORVINCALEUCOBLASTINE
Common Name English
vinflunine [INN]
Common Name English
VINFLUNINE [MART.]
Common Name English
Vinflunine [WHO-DD]
Common Name English
Classification Tree Code System Code
WHO-VATC QL01CA05
Created by admin on Sat Dec 16 17:40:39 UTC 2023 , Edited by admin on Sat Dec 16 17:40:39 UTC 2023
NCI_THESAURUS C932
Created by admin on Sat Dec 16 17:40:39 UTC 2023 , Edited by admin on Sat Dec 16 17:40:39 UTC 2023
EMA ASSESSMENT REPORTS JAVLOR (AUTHORIZED: CARCINOMA, TRANSITIONAL CELL, UROLOGIC NEOPLASM)
Created by admin on Sat Dec 16 17:40:39 UTC 2023 , Edited by admin on Sat Dec 16 17:40:39 UTC 2023
WHO-ATC L01CA05
Created by admin on Sat Dec 16 17:40:39 UTC 2023 , Edited by admin on Sat Dec 16 17:40:39 UTC 2023
NCI_THESAURUS C67422
Created by admin on Sat Dec 16 17:40:39 UTC 2023 , Edited by admin on Sat Dec 16 17:40:39 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID30936722
Created by admin on Sat Dec 16 17:40:39 UTC 2023 , Edited by admin on Sat Dec 16 17:40:39 UTC 2023
PRIMARY
MERCK INDEX
m11456
Created by admin on Sat Dec 16 17:40:39 UTC 2023 , Edited by admin on Sat Dec 16 17:40:39 UTC 2023
PRIMARY Merck Index
SMS_ID
100000079091
Created by admin on Sat Dec 16 17:40:39 UTC 2023 , Edited by admin on Sat Dec 16 17:40:39 UTC 2023
PRIMARY
EVMPD
SUB00063MIG
Created by admin on Sat Dec 16 17:40:39 UTC 2023 , Edited by admin on Sat Dec 16 17:40:39 UTC 2023
PRIMARY
CAS
162652-95-1
Created by admin on Sat Dec 16 17:40:39 UTC 2023 , Edited by admin on Sat Dec 16 17:40:39 UTC 2023
PRIMARY
ChEMBL
CHEMBL2110725
Created by admin on Sat Dec 16 17:40:39 UTC 2023 , Edited by admin on Sat Dec 16 17:40:39 UTC 2023
PRIMARY
DRUG CENTRAL
3644
Created by admin on Sat Dec 16 17:40:39 UTC 2023 , Edited by admin on Sat Dec 16 17:40:39 UTC 2023
PRIMARY
DRUG BANK
DB11641
Created by admin on Sat Dec 16 17:40:39 UTC 2023 , Edited by admin on Sat Dec 16 17:40:39 UTC 2023
PRIMARY
WIKIPEDIA
Vinflunine
Created by admin on Sat Dec 16 17:40:39 UTC 2023 , Edited by admin on Sat Dec 16 17:40:39 UTC 2023
PRIMARY
INN
7499
Created by admin on Sat Dec 16 17:40:39 UTC 2023 , Edited by admin on Sat Dec 16 17:40:39 UTC 2023
PRIMARY
PUBCHEM
10629256
Created by admin on Sat Dec 16 17:40:39 UTC 2023 , Edited by admin on Sat Dec 16 17:40:39 UTC 2023
PRIMARY
FDA UNII
5BF646324K
Created by admin on Sat Dec 16 17:40:39 UTC 2023 , Edited by admin on Sat Dec 16 17:40:39 UTC 2023
PRIMARY
MESH
C111217
Created by admin on Sat Dec 16 17:40:39 UTC 2023 , Edited by admin on Sat Dec 16 17:40:39 UTC 2023
PRIMARY
CHEBI
90241
Created by admin on Sat Dec 16 17:40:39 UTC 2023 , Edited by admin on Sat Dec 16 17:40:39 UTC 2023
PRIMARY
NCI_THESAURUS
C61564
Created by admin on Sat Dec 16 17:40:39 UTC 2023 , Edited by admin on Sat Dec 16 17:40:39 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY