INDIMITECAN

Details

Stereochemistry	ACHIRAL
Molecular Formula	C25H21N3O6
Molecular Weight	459.4507
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=C(OC)C=C2C(=O)N(CCCN3C=CN=C3)C4=C(C(=O)C5=C4C=C6OCOC6=C5)C2=C1

InChI

InChIKey=GCILEJUNEYIABW-UHFFFAOYSA-N

InChI=1S/C25H21N3O6/c1-31-18-8-14-17(11-19(18)32-2)25(30)28(6-3-5-27-7-4-26-12-27)23-15-9-20-21(34-13-33-20)10-16(15)24(29)22(14)23/h4,7-12H,3,5-6,13H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C25H21N3O6
Molecular Weight	459.4507
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:40:41 UTC 2023` Edited by `admin` on `Fri Dec 15 16:40:41 UTC 2023`
Record UNII	V5T7S4HP8A
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

INDIMITECAN

Common Name

English

NSC-725776

Code

English

5H-(1,3)DIOXOLO(4',5':5,6)INDENO(1,2-C)ISOQUINOLINE-5,12(6H)-DIONE, 6-(3-(1H-IMIDAZOL-1-YL)PROPYL)-2,3-DIMETHOXY-

Systematic Name

English

Classification Tree Code System Code

NCI_THESAURUS

C2843