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

Details

Stereochemistry ABSOLUTE
Molecular Formula C33H38N4O6.ClH.3H2O
Molecular Weight 677.185
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IRINOTECAN HYDROCHLORIDE

SMILES

O.O.O.Cl.CCC1=C2C=C(OC(=O)N3CCC(CC3)N4CCCCC4)C=CC2=NC5=C1CN6C5=CC7=C(COC(=O)[C@]7(O)CC)C6=O

InChI

InChIKey=KLEAIHJJLUAXIQ-JDRGBKBRSA-N
InChI=1S/C33H38N4O6.ClH.3H2O/c1-3-22-23-16-21(43-32(40)36-14-10-20(11-15-36)35-12-6-5-7-13-35)8-9-27(23)34-29-24(22)18-37-28(29)17-26-25(30(37)38)19-42-31(39)33(26,41)4-2;;;;/h8-9,16-17,20,41H,3-7,10-15,18-19H2,1-2H3;1H;3*1H2/t33-;;;;/m0..../s1

HIDE SMILES / InChI
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
Molecular Formula C33H38N4O6
Molecular Weight 586.678
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED
Molecular Formula ClH
Molecular Weight 36.461
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 15:32:57 UTC 2023
Edited
by admin
on Fri Dec 15 15:32:57 UTC 2023
Record UNII
042LAQ1IIS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IRINOTECAN HYDROCHLORIDE
MART.   ORANGE BOOK   USAN   USP   USP-RS   VANDF  
USAN  
Official Name English
IRINOTECAN HYDROCHLORIDE [MART.]
Common Name English
ONIVYDE
Brand Name English
U-101,440E
Code English
IRINOTECAN HYDROCHLORIDE [ORANGE BOOK]
Common Name English
IRINOTECAN HYDROCHLORIDE TRIHYDRATE [EP MONOGRAPH]
Common Name English
IRINOTECAN HYDROCHLORIDE [USP-RS]
Common Name English
IRINOTECAN HYDROCHLORIDE [USP MONOGRAPH]
Common Name English
IRINOTECAN HYDROCHLORIDE HYDRATE
JAN  
Common Name English
NSC-759878
Code English
XELIRI COMPONENT IRINOTECAN HYDROCHLORIDE
Common Name English
IRINOTECAN HYDROCHLORIDE [USAN]
Common Name English
(1,4'-BIPIPERIDINE)-1'-CARBOXYLIC ACID, 4,11-DIETHYL-3,4,12,14-TETRAHYDRO-4-HYDROXY-3,14-DIOXO-1H-PYRANO(3',4':6,7)INDOLIZINO(1,2-B)QUINOLIN-9-YL ESTER, MONOHYDROCHLORIDE, TRIHYDRATE, (S)-
Common Name English
CPT-11
Code English
CAMPTO
Brand Name English
IRINOTECAN HYDROCHLORIDE TRIHYDRATE
MI  
Common Name English
(+)-7-ETHYL-10-HYDROXYCAMPTOTHECINE 10-(1,4'-BIPIPERIDINE)-1'-CARBOXYLATE, MONOHYDROCHLORIDE, TRIHYDRATE
Common Name English
IRINOTECAN HYDROCHLORIDE TRIHYDRATE [EMA EPAR]
Common Name English
DQ-2805
Code English
IRINOTECAN HYDROCHLORIDE TRIHYDRATE [MI]
Common Name English
IRINOTECAN HYDROCHLORIDE HYDRATE [JAN]
Common Name English
CAMPTOSAR
Brand Name English
Irinotecan hydrochloride trihydrate [WHO-DD]
Common Name English
IRINOTECAN HYDROCHLORIDE [VANDF]
Common Name English
IRINOTECAN MONOHYDROCHLORIDE TRIHYDRATE
WHO-DD  
Common Name English
U-101440E
Code English
Classification Tree Code System Code
EU-Orphan Drug EU/3/11/933
Created by admin on Fri Dec 15 15:32:57 UTC 2023 , Edited by admin on Fri Dec 15 15:32:57 UTC 2023
EMA ASSESSMENT REPORTS ONIVYDE (AUTHORIZED: PANCREATIC NEOPLASMS):
Created by admin on Fri Dec 15 15:32:57 UTC 2023 , Edited by admin on Fri Dec 15 15:32:57 UTC 2023
NCI_THESAURUS C2843
Created by admin on Fri Dec 15 15:32:57 UTC 2023 , Edited by admin on Fri Dec 15 15:32:57 UTC 2023
Code System Code Type Description
USAN
HH-3
Created by admin on Fri Dec 15 15:32:57 UTC 2023 , Edited by admin on Fri Dec 15 15:32:57 UTC 2023
PRIMARY
PUBCHEM
60837
Created by admin on Fri Dec 15 15:32:57 UTC 2023 , Edited by admin on Fri Dec 15 15:32:57 UTC 2023
PRIMARY
EPA CompTox
DTXSID60929485
Created by admin on Fri Dec 15 15:32:57 UTC 2023 , Edited by admin on Fri Dec 15 15:32:57 UTC 2023
PRIMARY
NSC
759878
Created by admin on Fri Dec 15 15:32:57 UTC 2023 , Edited by admin on Fri Dec 15 15:32:57 UTC 2023
PRIMARY
DAILYMED
042LAQ1IIS
Created by admin on Fri Dec 15 15:32:57 UTC 2023 , Edited by admin on Fri Dec 15 15:32:57 UTC 2023
PRIMARY
EVMPD
SUB02772MIG
Created by admin on Fri Dec 15 15:32:57 UTC 2023 , Edited by admin on Fri Dec 15 15:32:57 UTC 2023
PRIMARY
RXCUI
153329
Created by admin on Fri Dec 15 15:32:57 UTC 2023 , Edited by admin on Fri Dec 15 15:32:57 UTC 2023
PRIMARY RxNorm
EVMPD
SUB45873
Created by admin on Fri Dec 15 15:32:57 UTC 2023 , Edited by admin on Fri Dec 15 15:32:57 UTC 2023
PRIMARY
FDA UNII
042LAQ1IIS
Created by admin on Fri Dec 15 15:32:57 UTC 2023 , Edited by admin on Fri Dec 15 15:32:57 UTC 2023
PRIMARY
CHEBI
90881
Created by admin on Fri Dec 15 15:32:57 UTC 2023 , Edited by admin on Fri Dec 15 15:32:57 UTC 2023
PRIMARY
NCI_THESAURUS
C1381
Created by admin on Fri Dec 15 15:32:57 UTC 2023 , Edited by admin on Fri Dec 15 15:32:57 UTC 2023
PRIMARY
CAS
136572-09-3
Created by admin on Fri Dec 15 15:32:57 UTC 2023 , Edited by admin on Fri Dec 15 15:32:57 UTC 2023
PRIMARY
SMS_ID
100000131566
Created by admin on Fri Dec 15 15:32:57 UTC 2023 , Edited by admin on Fri Dec 15 15:32:57 UTC 2023
PRIMARY
RS_ITEM_NUM
1347609
Created by admin on Fri Dec 15 15:32:57 UTC 2023 , Edited by admin on Fri Dec 15 15:32:57 UTC 2023
PRIMARY
ChEMBL
CHEMBL481
Created by admin on Fri Dec 15 15:32:57 UTC 2023 , Edited by admin on Fri Dec 15 15:32:57 UTC 2023
PRIMARY
MERCK INDEX
m6405
Created by admin on Fri Dec 15 15:32:57 UTC 2023 , Edited by admin on Fri Dec 15 15:32:57 UTC 2023
PRIMARY Merck Index
DRUG BANK
DBSALT000103
Created by admin on Fri Dec 15 15:32:57 UTC 2023 , Edited by admin on Fri Dec 15 15:32:57 UTC 2023
PRIMARY
CHEBI
5971
Created by admin on Fri Dec 15 15:32:57 UTC 2023 , Edited by admin on Fri Dec 15 15:32:57 UTC 2023
PRIMARY
Related Record Type Details
Structure of IRINOTECAN HYDROCHLORIDE ANHYDROUS
ANHYDROUS->SOLVATE
Structure of IRINOTECAN
PARENT -> SALT/SOLVATE
Related Record Type Details
Structure of 11-ETHYL IRINOTECAN
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
Structure of CAMPTOTHECIN
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
Structure of 7,11-DIETHYL-10-HYDROXY CAMPTOTHECIN
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
Structure of 7-ETHYL-10-HYDROXYCAMPTOTHECIN
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
Structure of 10-HYDROXYCAMPTOTHECIN
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
Structure of 7-ETHYLCAMPTOTHECIN
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
Structure of 7-DESETHYL IRINOTECAN
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
Related Record Type Details
Structure of IRINOTECAN
ACTIVE MOIETY
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966