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

Details

Stereochemistry ABSOLUTE
Molecular Formula C22H18N2O5
Molecular Weight 390.3887
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CAMPTOTHECIN ACETATE

SMILES

CC[C@@]1(OC(C)=O)C(=O)OCC2=C1C=C3N(CC4=CC5=CC=CC=C5N=C34)C2=O

InChI

InChIKey=ASVIEXKOXDCZDF-QFIPXVFZSA-N
InChI=1S/C22H18N2O5/c1-3-22(29-12(2)25)16-9-18-19-14(8-13-6-4-5-7-17(13)23-19)10-24(18)20(26)15(16)11-28-21(22)27/h4-9H,3,10-11H2,1-2H3/t22-/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H18N2O5
Molecular Weight 390.3887
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
679.0 nM [IC50]
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:35:12 GMT 2023
Edited
by admin
on Sat Dec 16 08:35:12 GMT 2023
Record UNII
1V364427UG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CAMPTOTHECIN ACETATE
MI  
Common Name English
20-O-ACETYLCAMPTOTHECIN
Common Name English
NSC-95382
Code English
CAMPTOTHECIN ACETATE, (+)-
Common Name English
20(S)-CAMPTOTHECIN ACETATE
Common Name English
CAMPTOTHECIN ACETATE [MI]
Common Name English
O-ACETYLCAMPTOTHECINE
Common Name English
1H-PYRANO(3',4':6,7)INDOLIZINO(1,2-B)QUINOLINE-3,14(4H,12H)-DIONE, 4-(ACETYLOXY)-4-ETHYL-, (4S)-
Systematic Name English
CAMPTOTHECINE, ACETATE (ESTER)
Common Name English
Code System Code Type Description
MERCK INDEX
m3007
Created by admin on Sat Dec 16 08:35:12 GMT 2023 , Edited by admin on Sat Dec 16 08:35:12 GMT 2023
PRIMARY Merck Index
CAS
7688-64-4
Created by admin on Sat Dec 16 08:35:12 GMT 2023 , Edited by admin on Sat Dec 16 08:35:12 GMT 2023
PRIMARY
FDA UNII
1V364427UG
Created by admin on Sat Dec 16 08:35:12 GMT 2023 , Edited by admin on Sat Dec 16 08:35:12 GMT 2023
PRIMARY
NSC
95382
Created by admin on Sat Dec 16 08:35:12 GMT 2023 , Edited by admin on Sat Dec 16 08:35:12 GMT 2023
PRIMARY
PUBCHEM
9886692
Created by admin on Sat Dec 16 08:35:12 GMT 2023 , Edited by admin on Sat Dec 16 08:35:12 GMT 2023
PRIMARY