Irinotecan

Catalog Number	ACM97682445-1
CAS Number	97682-44-5
Structure
Synonyms	Camptosar
IUPAC Name	[(19S)-10,19-Diethyl-19-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate
Molecular Weight	586.7
Molecular Formula	C33H38N4O6
Canonical SMILES	CCC1=C2CN3C(=CC4=C(C3=O)COC(=O)C4(CC)O)C2=NC5=C1C=C(C=C5)OC(=O)N6CCC(CC6)N7CCCCC7
InChI	InChI=1S/C33H38N4O6/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/t33-/m0/s1
InChI Key	UWKQSNNFCGGAFS-XIFFEERXSA-N
Purity	98%+(HPLC)
Storage	Store at 4 °C, sealed, away from light (valid for 2 years under this condition).
Complexity	1200
Exact Mass	586.27913494
Heavy Atom Count	43
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
Monoisotopic Mass	586.27913494
Topological Polar Surface Area	113Ų

Custom Q&A

What is the synonym for Irinotecan in the reference?

Irinotecan (free Base), Irinotecan(TECANS), DQ-2805, SN-38-11, etc.

What is the molecular formula of Irinotecan?

The molecular formula of Irinotecan is C33H38N4O6.

What is the storage temperature recommended for Irinotecan?

It is recommended to store Irinotecan sealed in dry, 2-8°C.

What is the color of Irinotecan?

The color of Irinotecan is white to brown.

What is the boiling point of Irinotecan?

The boiling point of Irinotecan is predicted to be 873.4±65.0 °C.

What are the hazard codes associated with Irinotecan?

Irinotecan has the hazard code Xn.

What is the brand name of Irinotecan?

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

What is the biological activity of Irinotecan?

Irinotecan is a prodrug for treating metastatic colorectal cancer and is a topoisomerase I inhibitor for certain cell lines.

How is Irinotecan used in combination with other substances for treatment?

Irinotecan is used in combination with fluorouracil and leucovorin for the treatment of patients with metastatic adenocarcinoma of the pancreas after disease progression following gemcitabine-based therapy.

How is Irinotecan converted to its active metabolite in the body?

In vivo, Irinotecan is converted to its active metabolite, SN-38, by carboxylesterase converting enzyme (CCE).

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