Identiteet

Exatecan intermediate 9

Pole loetletud · C26H24FN3O5

01Identiteet

Lazychem ID	LC-45571
CAS RN	Pole loetletud
PubChem CID	12067229
Molecular formula	C26H24FN3O5
Molecular weight	477.5 g/mol
IUPAC name	N-[(10S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]acetamide
InChIKey	SRCUCWPOTBGIQM-IHZSNKTASA-N

02Struktuur ja stereokeemia

Two-dimensional chemical structure of Exatecan intermediate 9 — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 6 rings, includes aromatic atoms, includes aliphatic carbon, has 1 defined stereocentre, contains at least one halogen atom. These statements are calculated from the published structure string.

Defined stereocentres	1
Ring count	6
Secondary amines	0
Tertiary amines	0

SMILES	CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=C5C(CCC6=C5C(=CC(=C6C)F)N=C4C3=C2)NC(=O)C)O
InChI	Pole loetletud

03Stereochemistry

The published structure contains 1 defined and 1 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres1Structure assigned

Unassigned centres1Structure unspecified

Assignment statusPartially assignedExact published identity

Tetrahedral upper bound≤ 4Before symmetry reduction

Published same-connectivity configurations

2 records

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.