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Details

Stereochemistry ABSOLUTE
Molecular Formula C33H38N4O6.ClH
Molecular Weight 623.139
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IRINOTECAN HYDROCHLORIDE ANHYDROUS

SMILES

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=GURKHSYORGJETM-WAQYZQTGSA-N
InChI=1S/C33H38N4O6.ClH/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/t33-;/m0./s1

HIDE SMILES / InChI

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

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

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 05:41:58 UTC 2023
Edited
by admin
on Sat Dec 16 05:41:58 UTC 2023
Record UNII
06X131E4OE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IRINOTECAN HYDROCHLORIDE ANHYDROUS
Common Name English
(1,4'-BIPIPERIDINE)-1'-CARBOXYLIC ACID, (4S)-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, HYDROCHLORIDE (1:1)
Common Name English
(+)-7-ETHYL-10-HYDROXYCAMPTOTHECINE 10-(1,4'-BIPIPERIDINE)-1'-CARBOXYLATE, MONOHYDROCHLORIDE
Common Name English
IRINOTECAN HYDROCHLORIDE ANHYDROUS [MI]
Common Name English
Irinotecan hydrochloride [WHO-DD]
Common Name English
Code System Code Type Description
PUBCHEM
74990
Created by admin on Sat Dec 16 05:41:59 UTC 2023 , Edited by admin on Sat Dec 16 05:41:59 UTC 2023
PRIMARY
FDA UNII
06X131E4OE
Created by admin on Sat Dec 16 05:41:59 UTC 2023 , Edited by admin on Sat Dec 16 05:41:59 UTC 2023
PRIMARY
SMS_ID
100000090561
Created by admin on Sat Dec 16 05:41:59 UTC 2023 , Edited by admin on Sat Dec 16 05:41:59 UTC 2023
PRIMARY
CAS
100286-90-6
Created by admin on Sat Dec 16 05:41:59 UTC 2023 , Edited by admin on Sat Dec 16 05:41:59 UTC 2023
PRIMARY
MERCK INDEX
m6405
Created by admin on Sat Dec 16 05:41:59 UTC 2023 , Edited by admin on Sat Dec 16 05:41:59 UTC 2023
PRIMARY
EPA CompTox
DTXSID6045953
Created by admin on Sat Dec 16 05:41:59 UTC 2023 , Edited by admin on Sat Dec 16 05:41:59 UTC 2023
PRIMARY
DRUG BANK
DB00762
Created by admin on Sat Dec 16 05:41:59 UTC 2023 , Edited by admin on Sat Dec 16 05:41:59 UTC 2023
PRIMARY
Related Record Type Details
SOLVATE->ANHYDROUS
Related Record Type Details
ACTIVE MOIETY