Chemical Compound

SCHEMBL27074372

CAS Registry Number 1608495-96-0
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SCHEMBL27074372 chemical structure
Primary Record

SCHEMBL27074372

In stock
4,849 g
Purity
99.6 %
CAS
1608495-96-0

Compound Identifiers & Properties

CAS
1608495-96-0
PubChem CID
163333203
SMILES
C1C[C@@H]2[C@@H](C2COC(=O)NCCNC(=O)CC[C@@H](C(=O)O)NC(=O)C3=CC=C(C=C3)NCC4=CN=C5C(=N4)C(=O)NC(=N5)N)CCC#C1
Canonical SMILES
Nc1nc2ncc(CNc3ccc(C(=O)N[C@@H](CCC(=O)NCCNC(=O)OCC4[C@H]5CCC#CCC[C@@H]45)C(=O)O)cc3)nc2c(=O)[nH]1

Names & Synonyms

  • SCHEMBL27074372
  • SCHEMBL30756629
  • Folate-amido-C2-amine-endo-BCN
  • 1608495-96-0