U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C18H22O6
Molecular Weight 334.3637
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of COMBRETASTATIN

SMILES

COC1=CC=C(C[C@@H](O)C2=CC(OC)=C(OC)C(OC)=C2)C=C1O

InChI

InChIKey=LGZKGOGODCLQHG-CYBMUJFWSA-N
InChI=1S/C18H22O6/c1-21-15-6-5-11(8-14(15)20)7-13(19)12-9-16(22-2)18(24-4)17(10-12)23-3/h5-6,8-10,13,19-20H,7H2,1-4H3/t13-/m1/s1

HIDE SMILES / InChI

Molecular Formula C18H22O6
Molecular Weight 334.3637
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Description
Curator's Comment: Note: most of the information on combretastatin is in fact related to a combretastatin analog Combretastatin A4

Combretastatin is a phenol derivative isolated from the bark of Combretum caffrum, commonly known as South African Bush Willow. Combretastatin is an effective antimitotic agent, and like colchicine, inhibited tubulin polymerization and stimulated tubulin-dependent GTP hydrolysis.

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 18:11:55 GMT 2023
Edited
by admin
on Fri Dec 15 18:11:55 GMT 2023
Record UNII
7O62J06F18
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
COMBRETASTATIN
MI  
Common Name English
COMBRETASTATIN, (-)-
Common Name English
(-)-COMBRETASTATIN
Common Name English
(R)-(-)-COMBRETASTATIN
Common Name English
NSC-348103
Code English
COMBRETASTATIN [MI]
Common Name English
BENZENEETHANOL, 3-HYDROXY-4-METHOXY-.ALPHA.-(3,4,5-TRIMETHOXYPHENYL)-, (R)-
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C67421
Created by admin on Fri Dec 15 18:11:55 GMT 2023 , Edited by admin on Fri Dec 15 18:11:55 GMT 2023
Code System Code Type Description
SMS_ID
100000089840
Created by admin on Fri Dec 15 18:11:55 GMT 2023 , Edited by admin on Fri Dec 15 18:11:55 GMT 2023
PRIMARY
EPA CompTox
DTXSID80897571
Created by admin on Fri Dec 15 18:11:55 GMT 2023 , Edited by admin on Fri Dec 15 18:11:55 GMT 2023
PRIMARY
DRUG BANK
DB12596
Created by admin on Fri Dec 15 18:11:55 GMT 2023 , Edited by admin on Fri Dec 15 18:11:55 GMT 2023
PRIMARY
WIKIPEDIA
Combretastatin
Created by admin on Fri Dec 15 18:11:55 GMT 2023 , Edited by admin on Fri Dec 15 18:11:55 GMT 2023
PRIMARY
EVMPD
SUB26305
Created by admin on Fri Dec 15 18:11:55 GMT 2023 , Edited by admin on Fri Dec 15 18:11:55 GMT 2023
PRIMARY
PUBCHEM
9895264
Created by admin on Fri Dec 15 18:11:55 GMT 2023 , Edited by admin on Fri Dec 15 18:11:55 GMT 2023
PRIMARY
FDA UNII
7O62J06F18
Created by admin on Fri Dec 15 18:11:55 GMT 2023 , Edited by admin on Fri Dec 15 18:11:55 GMT 2023
PRIMARY
NCI_THESAURUS
C80014
Created by admin on Fri Dec 15 18:11:55 GMT 2023 , Edited by admin on Fri Dec 15 18:11:55 GMT 2023
PRIMARY
MESH
C040105
Created by admin on Fri Dec 15 18:11:55 GMT 2023 , Edited by admin on Fri Dec 15 18:11:55 GMT 2023
PRIMARY
CAS
82855-09-2
Created by admin on Fri Dec 15 18:11:55 GMT 2023 , Edited by admin on Fri Dec 15 18:11:55 GMT 2023
PRIMARY
NSC
348103
Created by admin on Fri Dec 15 18:11:55 GMT 2023 , Edited by admin on Fri Dec 15 18:11:55 GMT 2023
PRIMARY
MERCK INDEX
m3747
Created by admin on Fri Dec 15 18:11:55 GMT 2023 , Edited by admin on Fri Dec 15 18:11:55 GMT 2023
PRIMARY Merck Index