(Q27293722)

ent-Abacavir (English)

14 October 2016

2 references

inferred from InChIKey

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₁₄H₁₈N₆O

1 reference

ent-Abacavir (English)

14 October 2016

canonical SMILES

C1CC1NC2=NC(=NC3=C2N=CN3C4CC(C=C4)CO)N

1 reference

ent-Abacavir (English)

14 October 2016

isomeric SMILES

C1CC1NC2=NC(=NC3=C2N=CN3[C@H]4C[C@H](C=C4)CO)N

1 reference

ent-Abacavir (English)

CAS COVID-19 Anti-Viral Candidate Compounds

14 October 2016

catalog

0 references

Identifiers

InChI

InChI=1S/C14H18N6O/c15-14-18-12(17-9-2-3-9)11-13(19-14)20(7-16-11)10-4-1-8(5-10)6-21/h1,4,7-10,21H,2-3,5-6H2,(H3,15,17,18,19)/t8-,10+/m0/s1

1 reference

ent-Abacavir (English)

MCGSCOLBFJQGHM-WCBMZHEXSA-N

14 October 2016

InChIKey

1 reference

Global Substance Registration System

ent-Abacavir (English)

14 October 2016

2 references

UNII

X9A7099R51

https://commonchemistry.cas.org/detail?cas_rn=136470-79-6

((1R,4S)-4-(2-amino-6-(cyclopropylamino)-9H-purin-9-yl)cyclopent-2-enyl)methanol (English)

14 October 2016

7 April 2021

InChIKey

MCGSCOLBFJQGHM-WCBMZHEXSA-N

1 reference

{(1R,4S)-4-[2-Amino-6-(cyclopropylamino)-9H-purin-9-yl]-2-cyclopenten-1-yl}methanol (English)

14 October 2016

1 reference

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

ent-Abacavir (English)

14 October 2016

1 reference

inferred from InChIKey

1 reference

1 reference

DSSTOX compound identifier

0 references

1 reference

Global Substance Registration System

UNII

X9A7099R51