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Details

Stereochemistry ABSOLUTE
Molecular Formula C44H52N4O8
Molecular Weight 764.9057
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-DEOXY-3,4-DIDEHYDRO-8,24-DINORVINCALEUKOBLASTINE

SMILES

CCC1=C[C@@H]2CN(C1)CC3=C(NC4=C3C=CC=C4)[C@@](C2)(C(=O)OC)C5=C(OC)C=C6N(C)[C@@H]7[C@]8(CCN9CC=C[C@](CC)([C@@H]89)[C@@H](OC(C)=O)[C@]7(O)C(O)=O)C6=C5

InChI

InChIKey=DZBBXOKBKJHDOK-LMCLQTFVSA-N
InChI=1S/C44H52N4O8/c1-7-26-18-27-21-43(40(52)55-6,35-29(24-47(22-26)23-27)28-12-9-10-13-32(28)45-35)31-19-30-33(20-34(31)54-5)46(4)37-42(30)15-17-48-16-11-14-41(8-2,36(42)48)38(56-25(3)49)44(37,53)39(50)51/h9-14,18-20,27,36-38,45,53H,7-8,15-17,21-24H2,1-6H3,(H,50,51)/t27-,36-,37+,38+,41+,42+,43-,44-/m0/s1

HIDE SMILES / InChI

Molecular Formula C44H52N4O8
Molecular Weight 764.9057
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 03:36:52 GMT 2025
Edited
by admin
on Wed Apr 02 03:36:52 GMT 2025
Record UNII
G22T722CHH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-DEOXY-3,4-DIDEHYDRO-8,24-DINORVINCALEUKOBLASTINE
Common Name English
VINORELBINE TARTRATE IMPURITY H [EP IMPURITY]
Preferred Name English
ASPIDOSPERMIDINE-3-CARBOXYLIC ACID, 4-(ACETYLOXY)-6,7-DIDEHYDRO-15-((2R,6R,8S)-4-ETHYL-1,3,6,7,8,9-HEXAHYDRO-8-(METHOXYCARBONYL)-2,6-METHANO-2H-AZECINO(4,3-B)INDOL-8-YL)-3-HYDROXY-16-METHOXY-1-METHYL-, (2.BETA.,3.BETA.,4.BETA.,5.ALPHA.,12.BETA.,19.ALPHA.
Systematic Name English
ASPIDOSPERMIDINE-3-CARBOXYLIC ACID, 4-(ACETYLOXY)-6,7-DIDEHYDRO-15-((2R,6R,8S)-4-ETHYL-1,3,6,7,8,9-HEXAHYDRO-8-(METHOXYCARBONYL)-2,6-METHANO-2H-AZECINO(4,3-B)INDOL-8-YL)-3-HYDROXY-16-METHOXY-1-METHYL-, (2.BETA.,3.BETA.,4.BETA.,5.ALPHA.,12R,19.ALPHA.)-
Systematic Name English
(2.BETA.,3.BETA.,4.BETA.,5.ALPHA.,12R,19.ALPHA.)-4-(ACETYLOXY)-6,7-DIDEHYDRO-15-((2R,6R,8S)-4-ETHYL-1,3,6,7,8,9-HEXAHYDRO-8-(METHOXYCARBONYL)-2,6-METHANO-2H-AZECINO(4,3-B)INDOL-8-YL)-3-HYDROXY-16-METHOXY-1-METHYLASPIDOSPERMIDINE-3-CARBOXYLIC ACID
Systematic Name English
Code System Code Type Description
PUBCHEM
155928771
Created by admin on Wed Apr 02 03:36:52 GMT 2025 , Edited by admin on Wed Apr 02 03:36:52 GMT 2025
PRIMARY
CAS
220137-33-7
Created by admin on Wed Apr 02 03:36:52 GMT 2025 , Edited by admin on Wed Apr 02 03:36:52 GMT 2025
PRIMARY
FDA UNII
G22T722CHH
Created by admin on Wed Apr 02 03:36:52 GMT 2025 , Edited by admin on Wed Apr 02 03:36:52 GMT 2025
PRIMARY
Related Record Type Details
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CHROMATOGRAPHIC PURITY (HPLC/UV)
EP