rel-1,9-Dihydro-9-[(1R)-1-[(1S)-1-hydroxyethyl]heptyl]-6H-purin-6-one

CAS Registry Number®

76600-30-1
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CAS Name

rel-1,9-Dihydro-9-[(1R)-1-[(1S)-1-hydroxyethyl]heptyl]-6H-purin-6-one

Molecular Formula

C14H22N4O2

Molecular Mass

278.35

Cite this Page

rel-1,9-Dihydro-9-[(1R)-1-[(1S)-1-hydroxyethyl]heptyl]-6H-purin-6-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=76600-30-1 (retrieved 2024-09-11) (CAS RN: 76600-30-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C14H22N4O2/c1-3-4-5-6-7-11(10(2)19)18-9-17-12-13(18)15-8-16-14(12)20/h8-11,19H,3-7H2,1-2H3,(H,15,16,20)/t10-,11+/s2

InChIKey

InChIKey=RSMDQPNZAPMDJC-WIBLRKLZNA-N

SMILES

[C@H](CCCCCC)([C@@H](C)O)N1C2=C(N=C1)C(=O)N=CN2

Canonical SMILES

O=C1N=CNC2=C1N=CN2C(CCCCCC)C(O)C

Other Names for this Substance

  • 6H-Purin-6-one, 1,9-dihydro-9-[(1R)-1-[(1S)-1-hydroxyethyl]heptyl]-, rel-
  • 6H-Purin-6-one, 1,9-dihydro-9-[1-(1-hydroxyethyl)heptyl]-, (R*,S*)-
  • rel-1,9-Dihydro-9-[(1R)-1-[(1S)-1-hydroxyethyl]heptyl]-6H-purin-6-one
  • NPT 15392
  • Nosantine

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Deleted or Replaced CAS Registry Numbers

77641-63-5