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Details

Stereochemistry ABSOLUTE
Molecular Formula C45H54F2N4O8.2C4H6O6
Molecular Weight 1117.1027
Optical Activity UNSPECIFIED
Defined Stereocenters 14 / 14
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VINFLUNINE DITARTRATE

SMILES

O[C@H]([C@@H](O)C(O)=O)C(O)=O.O[C@H]([C@@H](O)C(O)=O)C(O)=O.[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=YIHUEPHBPPAAHH-IIQAEXPMSA-N
InChI=1S/C45H54F2N4O8.2C4H6O6/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;2*5-1(3(7)8)2(6)4(9)10/h9-14,19-20,26-27,36-38,48,55H,8,15-18,21-24H2,1-7H3;2*1-2,5-6H,(H,7,8)(H,9,10)/t26-,27+,36-,37+,38+,42+,43+,44-,45-;2*1-,2-/m011/s1

HIDE SMILES / InChI

Molecular Formula C4H6O6
Molecular Weight 150.0868
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

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 Fri Dec 15 15:45:44 UTC 2023
Edited
by admin
on Fri Dec 15 15:45:44 UTC 2023
Record UNII
33MG53C7XW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VINFLUNINE DITARTRATE
MI   USAN   WHO-DD  
USAN  
Official Name English
VINFLUNINE BITARTRATE
Common Name English
Vinflunine ditartrate [WHO-DD]
Common Name English
VINFLUNINE DITARTRATE [USAN]
Common Name English
VINFLUNINE DITARTRATE [MI]
Common Name English
4'-DEOXY-20',20'-DIFLUORO-8'-NORVINCALEUKOBLASTINE BITARTRATE
Common Name English
F-12158
Code English
BMS-710485
Code English
VINFLUNINE TARTRATE [MART.]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C67422
Created by admin on Fri Dec 15 15:45:44 UTC 2023 , Edited by admin on Fri Dec 15 15:45:44 UTC 2023
EMA ASSESSMENT REPORTS JAVLOR (AUTHORIZED: UROLOGIC NEOPLASMS)
Created by admin on Fri Dec 15 15:45:44 UTC 2023 , Edited by admin on Fri Dec 15 15:45:44 UTC 2023
Code System Code Type Description
ChEMBL
CHEMBL2110725
Created by admin on Fri Dec 15 15:45:44 UTC 2023 , Edited by admin on Fri Dec 15 15:45:44 UTC 2023
PRIMARY
USAN
TT-79
Created by admin on Fri Dec 15 15:45:44 UTC 2023 , Edited by admin on Fri Dec 15 15:45:44 UTC 2023
PRIMARY
SMS_ID
100000092200
Created by admin on Fri Dec 15 15:45:44 UTC 2023 , Edited by admin on Fri Dec 15 15:45:44 UTC 2023
PRIMARY
CAS
194468-36-5
Created by admin on Fri Dec 15 15:45:44 UTC 2023 , Edited by admin on Fri Dec 15 15:45:44 UTC 2023
PRIMARY
EVMPD
SUB28421
Created by admin on Fri Dec 15 15:45:44 UTC 2023 , Edited by admin on Fri Dec 15 15:45:44 UTC 2023
PRIMARY
PUBCHEM
16220212
Created by admin on Fri Dec 15 15:45:44 UTC 2023 , Edited by admin on Fri Dec 15 15:45:44 UTC 2023
PRIMARY
CHEBI
90241
Created by admin on Fri Dec 15 15:45:44 UTC 2023 , Edited by admin on Fri Dec 15 15:45:44 UTC 2023
PRIMARY
EPA CompTox
DTXSID80870081
Created by admin on Fri Dec 15 15:45:44 UTC 2023 , Edited by admin on Fri Dec 15 15:45:44 UTC 2023
PRIMARY
FDA UNII
33MG53C7XW
Created by admin on Fri Dec 15 15:45:44 UTC 2023 , Edited by admin on Fri Dec 15 15:45:44 UTC 2023
PRIMARY
MERCK INDEX
m11456
Created by admin on Fri Dec 15 15:45:44 UTC 2023 , Edited by admin on Fri Dec 15 15:45:44 UTC 2023
PRIMARY Merck Index
DRUG BANK
DBSALT002672
Created by admin on Fri Dec 15 15:45:44 UTC 2023 , Edited by admin on Fri Dec 15 15:45:44 UTC 2023
PRIMARY
NCI_THESAURUS
C76266
Created by admin on Fri Dec 15 15:45:44 UTC 2023 , Edited by admin on Fri Dec 15 15:45:44 UTC 2023
PRIMARY
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