Azonosítás

Vancomycin EP Impurity L

CAS 79517-31-0 · C66H74Cl2N8O25

01Azonosítás

Lazychem IDLC-30569
CAS RN79517-31-0
PubChem CID162914257
Molecular formulaC66H74Cl2N8O25
Molecular weight1450.2 g/mol
IUPAC name[L-alpha-Asp3]vancomycin B
InChIKeyUHOHFBMFLQATLQ-UHFFFAOYSA-N

02Szerkezet és sztereokémia

2D structurePubChem CID 162914257
Two-dimensional chemical structure of Vancomycin EP Impurity L, CAS 79517-31-0
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 12 rings, includes aromatic atoms, includes aliphatic carbon, contains at least one halogen atom. These statements are calculated from the published structure string.

Defined stereocentres0
Ring count12
Secondary amines1
Tertiary amines0
SMILESCC1C(C(CC(O1)OC2C(C(C(OC2OC3=C4C=C5C=C3OC6=C(C=C(C=C6)C(C(C(=O)NC(C(=O)NC5C(=O)NC7C8=CC(=C(C=C8)O)C9=C(C=C(C=C9O)O)C(NC(=O)C(C(C1=CC(=C(O4)C=C1)Cl)O)NC7=O)C(=O)O)CC(=O)O)NC(=O)C(CC(C)C)NC)O)Cl)CO)O)O)(C)N)O
InChINincs megadva

03Stereochemistry

The published structure contains 0 defined and 18 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres0Structure assigned
Unassigned centres18Structure unspecified
Assignment statusUnassignedExact published identity
Tetrahedral upper bound≤ 262,144Before 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.

04Indiai státusz

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

05Nevek és kapcsolatok

API és anyavegyület

VANCOMYCIN

Szennyezők és rokon vegyületek

Nevek és kapcsolatok

  • Vancomycin EP Impurity L
  • 79517-31-0
  • 23-De(aminocarbonyl)-23-carboxy Vancomycin

Szennyezők és rokon vegyületek

06Források