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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H23NO5.C4H6O6.H2O
Molecular Weight 525.5024
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-DEACETYLCOLCHICINE TARTRATE MONOHYDRATE

SMILES

O.O[C@H]([C@@H](O)C(O)=O)C(O)=O.COC1=C(OC)C(OC)=C2C(CC[C@H](N)C3=CC(=O)C(OC)=CC=C23)=C1

InChI

InChIKey=OBMKOHRHLIBDCR-NASHDYMQSA-N
InChI=1S/C20H23NO5.C4H6O6.H2O/c1-23-16-8-6-12-13(10-15(16)22)14(21)7-5-11-9-17(24-2)19(25-3)20(26-4)18(11)12;5-1(3(7)8)2(6)4(9)10;/h6,8-10,14H,5,7,21H2,1-4H3;1-2,5-6H,(H,7,8)(H,9,10);1H2/t14-;1-,2-;/m01./s1

HIDE SMILES / InChI

Molecular Formula C20H23NO5
Molecular Weight 357.4003
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

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 H2O
Molecular Weight 18.0153
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:22:33 GMT 2023
Edited
by admin
on Fri Dec 15 15:22:33 GMT 2023
Record UNII
1MSQ9O0VPM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-DEACETYLCOLCHICINE TARTRATE MONOHYDRATE
Common Name English
COLCHICINE, N-DEACETYL-, (+)-TARTRATE (1:1), MONOHYDRATE
Systematic Name English
BENZO(A)HEPTALEN-9(5H)-ONE, 7-AMINO-6,7-DIHYDRO-1,2,3,10-TETRAMETHOXY-, (S)-, (R-(R*,R*))-2,3-DIHYDROXYBUTANEDIOATE (1:1), MONOHYDRATE
Systematic Name English
BENZO(A)HEPTALEN-9(5H)-ONE, 7-AMINO-6,7-DIHYDRO-1,2,3,10-TETRAMETHOXY-, (S)-, (2R,3R)-2,3-DIHYDROXYBUTANEDIOATE (1:1), MONOHYDRATE
Systematic Name English
Code System Code Type Description
CAS
23255-02-9
Created by admin on Fri Dec 15 15:22:33 GMT 2023 , Edited by admin on Fri Dec 15 15:22:33 GMT 2023
PRIMARY
FDA UNII
1MSQ9O0VPM
Created by admin on Fri Dec 15 15:22:33 GMT 2023 , Edited by admin on Fri Dec 15 15:22:33 GMT 2023
PRIMARY
PUBCHEM
123133511
Created by admin on Fri Dec 15 15:22:33 GMT 2023 , Edited by admin on Fri Dec 15 15:22:33 GMT 2023
PRIMARY
CHEBI
566519
Created by admin on Fri Dec 15 15:22:33 GMT 2023 , Edited by admin on Fri Dec 15 15:22:33 GMT 2023
PRIMARY
Related Record Type Details
ANHYDROUS->SOLVATE
PARENT -> SALT/SOLVATE