Identitet

(-)-Vasicine

Ikke angivet · C11H12N2O

01Identitet

Lazychem IDLC-103447
CAS RNIkke angivet
PubChem CID667496
Molecular formulaC11H12N2O
Molecular weight188.23 g/mol
IUPAC name(3S)-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-3-ol
InChIKeyYIICVSCAKJMMDJ-JTQLQIEISA-N

02Struktur og stereokemi

2D structurePubChem CID 667496
Two-dimensional chemical structure of (-)-Vasicine
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 3 rings, includes aromatic atoms, includes aliphatic carbon, has 1 defined stereocentre. These statements are calculated from the published structure string.

Defined stereocentres1
Ring count3
Secondary amines0
Tertiary amines1
SMILESC1CN2CC3=CC=CC=C3N=C2[C@H]1O
InChIIkke angivet

03Stereochemistry

The published structure contains 1 defined and 0 unassigned tetrahedral stereocentre. The exact wedge and dash depiction is shown above.

Defined centres1Structure assigned
Unassigned centres0Structure unspecified
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 2Before symmetry reduction

Published same-connectivity configurations

1 record

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.

No additional structure-linked configuration with the same connectivity is currently present in the LazyChem dataset.

Scope: The mathematical 2^n value is only an upper bound. Symmetry and other stereogenic elements can change the number of distinct stereoisomers. A hypothetical configuration is not published as a compound record without a verified structure identity.

04Status i Indien

Exact-compound status is evaluated only against the published name and CAS number. Confirm the current official instrument before a regulatory decision.

05Navne og relationer

API og moderlægemiddel

Ikke angivet

Navne og relationer

    Urenheder og beslægtede forbindelser

      06Kilder