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Details

Stereochemistry ABSOLUTE
Molecular Formula C43H55N5O7.H2O4S
Molecular Weight 852.005
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VINDESINE SULFATE

SMILES

OS(O)(=O)=O.[H][C@@]12N3CC[C@@]14C5=CC(=C(OC)C=C5N(C)[C@@]4([H])[C@](O)([C@H](O)[C@]2(CC)C=CC3)C(N)=O)[C@]6(C[C@@]7([H])CN(C[C@](O)(CC)C7)CCC8=C6NC9=C8C=CC=C9)C(=O)OC

InChI

InChIKey=COFJBSXICYYSKG-OAUVCNBTSA-N
InChI=1S/C43H55N5O7.H2O4S/c1-6-39(52)21-25-22-42(38(51)55-5,33-27(13-17-47(23-25)24-39)26-11-8-9-12-30(26)45-33)29-19-28-31(20-32(29)54-4)46(3)35-41(28)15-18-48-16-10-14-40(7-2,34(41)48)36(49)43(35,53)37(44)50;1-5(2,3)4/h8-12,14,19-20,25,34-36,45,49,52-53H,6-7,13,15-18,21-24H2,1-5H3,(H2,44,50);(H2,1,2,3,4)/t25-,34-,35+,36+,39-,40+,41+,42-,43-;/m0./s1

HIDE SMILES / InChI
Molecular Formula C43H55N5O7
Molecular Weight 753.9261
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED
Molecular Formula H2O4S
Molecular Weight 98.078
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:05:42 UTC 2023
Edited
by admin
on Fri Dec 15 15:05:42 UTC 2023
Record UNII
CPH2U7DNDY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VINDESINE SULFATE
EP   JAN   MART.   USAN   VANDF   WHO-DD  
USAN  
Official Name English
VINDESINE SULFATE SALT
MI  
Common Name English
VINCALEUKOBLASTINE, 3-(AMINOCARBONYL)-O(SUP 4)-DEACETYL-3-DE(METHOXYCARBONYL)SULPHATE (1:1) (SALT)
Common Name English
LY-099094
Code English
3-CARBAMOYL-4-DEACETYL-3-DE(METHOXYCARBONYL)VINCALEUKOBLASTINE SULPHATE (1:1) (SALT)
Common Name English
VINDESINE SULFATE [EP IMPURITY]
Common Name English
3-Carbamoyl-4-deacetyl-3-de(methoxycarbonyl)vincaleukoblastine sulfate (1:1) (salt)
Common Name English
VINDESINE SULFATE [MART.]
Common Name English
FILDESIN
Brand Name English
Vindesine sulfate [WHO-DD]
Common Name English
NSC-245467
Code English
LY099094
Code English
VINDESINE SULFATE [JAN]
Common Name English
VINDESINE SULPHATE
Common Name English
VINDESINE SULFATE [EP MONOGRAPH]
Common Name English
VINDESINE SULFATE [USAN]
Common Name English
VINDESINE SULFATE [VANDF]
Common Name English
VINCALEUKOBLASTINE, 3-(AMINOCARBONYL)-O(SUP 4)-DEACETYL-3-DE(METHOXYCARBONYL)SULFATE (1:1) (SALT)
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C67422
Created by admin on Fri Dec 15 15:05:42 UTC 2023 , Edited by admin on Fri Dec 15 15:05:42 UTC 2023
NCI_THESAURUS C932
Created by admin on Fri Dec 15 15:05:42 UTC 2023 , Edited by admin on Fri Dec 15 15:05:42 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID0049074
Created by admin on Fri Dec 15 15:05:42 UTC 2023 , Edited by admin on Fri Dec 15 15:05:42 UTC 2023
PRIMARY
CHEBI
32295
Created by admin on Fri Dec 15 15:05:42 UTC 2023 , Edited by admin on Fri Dec 15 15:05:42 UTC 2023
PRIMARY
SMS_ID
100000087883
Created by admin on Fri Dec 15 15:05:42 UTC 2023 , Edited by admin on Fri Dec 15 15:05:42 UTC 2023
PRIMARY
NSC
245467
Created by admin on Fri Dec 15 15:05:42 UTC 2023 , Edited by admin on Fri Dec 15 15:05:42 UTC 2023
PRIMARY
ChEMBL
CHEMBL219146
Created by admin on Fri Dec 15 15:05:42 UTC 2023 , Edited by admin on Fri Dec 15 15:05:42 UTC 2023
PRIMARY
EVMPD
SUB05102MIG
Created by admin on Fri Dec 15 15:05:42 UTC 2023 , Edited by admin on Fri Dec 15 15:05:42 UTC 2023
PRIMARY
DRUG BANK
DBSALT000440
Created by admin on Fri Dec 15 15:05:42 UTC 2023 , Edited by admin on Fri Dec 15 15:05:42 UTC 2023
PRIMARY
CAS
59917-39-4
Created by admin on Fri Dec 15 15:05:42 UTC 2023 , Edited by admin on Fri Dec 15 15:05:42 UTC 2023
PRIMARY
FDA UNII
CPH2U7DNDY
Created by admin on Fri Dec 15 15:05:42 UTC 2023 , Edited by admin on Fri Dec 15 15:05:42 UTC 2023
PRIMARY
NCI_THESAURUS
C935
Created by admin on Fri Dec 15 15:05:42 UTC 2023 , Edited by admin on Fri Dec 15 15:05:42 UTC 2023
PRIMARY
ECHA (EC/EINECS)
261-984-7
Created by admin on Fri Dec 15 15:05:42 UTC 2023 , Edited by admin on Fri Dec 15 15:05:42 UTC 2023
PRIMARY
PUBCHEM
76958180
Created by admin on Fri Dec 15 15:05:42 UTC 2023 , Edited by admin on Fri Dec 15 15:05:42 UTC 2023
PRIMARY
MERCK INDEX
m11454
Created by admin on Fri Dec 15 15:05:42 UTC 2023 , Edited by admin on Fri Dec 15 15:05:42 UTC 2023
PRIMARY Merck Index
RXCUI
11205
Created by admin on Fri Dec 15 15:05:42 UTC 2023 , Edited by admin on Fri Dec 15 15:05:42 UTC 2023
PRIMARY RxNorm
Related Record Type Details
Structure of VINDESINE
PARENT -> SALT/SOLVATE
Related Record Type Details
Structure of VINBLASTINE
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Structure of 4-DESACETYLVINBLASTINE HYDRAZIDE
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Structure of 3-(CARBAMOYL)-O4-DEACETYL-3-DE(METHOXYCARBONYL)VINCALEUKOBLASTINE N6-OXIDE
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Related Record Type Details
Structure of VINDESINE
ACTIVE MOIETY
NIH
NCATS
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