Irinotecan hydrochloride trihydrate

Catalog Number	ACM136572093
CAS Number	136572-09-3
Structure
Description	Irinotecan hydrochloride trihydrate ((+)-Irinotecan hydrochloride trihydrate) is a topoisomerase I inhibitor with antitumor activity.
Synonyms	7-Ethyl-10-[4-(1-piperidino)-1-piperidino]carbonyloxycamptothecin hydrochloride trihydrate
Molecular Weight	677.2
InChI	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
InChI Key	KLEAIHJJLUAXIQ-JDRGBKBRSA-N
Melting Point	250-256 °C
Purity	98%+
Complexity	1200
Covalently-Bonded Unit Count	5
Defined Atom Stereocenter Count	1
Exact Mass	676.2875067
Heavy Atom Count	47
Hydrogen Bond Acceptor Count	11
Hydrogen Bond Donor Count	5
Isomeric SMILES	CCC1=C2CN3C(=CC4=C(C3=O)COC(=O)[C@@]4(CC)O)C2=NC5=C1C=C(C=C5)OC(=O)N6CCC(CC6)N7CCCCC7.O.O.O.Cl
Monoisotopic Mass	676.2875067
PhysicalState	Solid
Rotatable Bond Count	5
Topological Polar Surface Area	116 Ų

Custom Q&A

What is the chemical formula for Irinotecan hydrochloride trihydrate?

The chemical formula for Irinotecan hydrochloride trihydrate is C33H45ClN4O9.

What is the molecular weight of Irinotecan hydrochloride trihydrate?

The molecular weight of Irinotecan hydrochloride trihydrate is 677.18.

What is the boiling point of Irinotecan hydrochloride trihydrate?

The boiling point of Irinotecan hydrochloride trihydrate is 257°C.

Is Irinotecan hydrochloride trihydrate soluble in water?

Yes, Irinotecan hydrochloride trihydrate is soluble in water (up to 4 mg/ml).

How should Irinotecan hydrochloride trihydrate be stored?

Irinotecan hydrochloride trihydrate should be stored at 2-8°C.

What is the stability of Irinotecan hydrochloride trihydrate?

Irinotecan hydrochloride trihydrate is stable for 1 year from the date of purchase as supplied.

How is Irinotecan hydrochloride trihydrate used in the medical field?

Irinotecan hydrochloride trihydrate is used as a DNA topoisomerase inhibitor for anticancer treatment.

What is the brand name of Irinotecan hydrochloride trihydrate?

The brand name of Irinotecan hydrochloride trihydrate is Camptosar (Pharmacia & Upjohn).

What is the hazard classification of Irinotecan hydrochloride trihydrate?

Irinotecan hydrochloride trihydrate is moderately toxic by ingestion.

What is the primary active metabolite of Irinotecan hydrochloride trihydrate?

The primary active metabolite of Irinotecan hydrochloride trihydrate is SN-38, which is approximately 1000 times more potent as a DNA topoisomerase I inhibitor.

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