Identita

D-Tryptophan benzyl ester

Neuvedeno · C18H18N2O2

01Identita

Lazychem IDLC-83344
CAS RNNeuvedeno
PubChem CID6995075
Molecular formulaC18H18N2O2
Molecular weight294.3 g/mol
IUPAC namebenzyl (2R)-2-amino-3-(1H-indol-3-yl)propanoate
InChIKeyTYQYRKDGHAPZRF-MRXNPFEDSA-N

02Struktura a stereochemie

2D structurePubChem CID 6995075
Two-dimensional chemical structure of D-Tryptophan benzyl ester
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 amines0
SMILESC1=CC=C(C=C1)COC(=O)[C@@H](CC2=CNC3=CC=CC=C32)N
InChINeuvedeno

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

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.

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.

04Stav v Indii

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

05Názvy a vztahy

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      06Zdroje