(Q27105145)

Adenosine-5'-(N-propyl)carboxamide (English)

19 October 2016

chemical formula

C₁₃H₁₈N₆O₄

1 reference

Adenosine-5'-(N-propyl)carboxamide (English)

19 October 2016

canonical SMILES

CCCNC(=O)C1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)O

1 reference

Adenosine-5'-(N-propyl)carboxamide (English)

19 October 2016

isomeric SMILES

CCCNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=CN=C3N)O)O

1 reference

Adenosine-5'-(N-propyl)carboxamide (English)

InChI=1S/C13H18N6O4/c1-2-3-15-12(22)9-7(20)8(21)13(23-9)19-5-18-6-10(14)16-4-17-11(6)19/h4-5,7-9,13,20-21H,2-3H2,1H3,(H,15,22)(H2,14,16,17)/t7-,8+,9-,13+/m0/s1

19 October 2016

Identifiers

InChI

1 reference

Adenosine-5'-(N-propyl)carboxamide (English)

19 October 2016

2 references

Adenosine-5'-(N-propyl)carboxamide (English)

19 October 2016

stated in

ChEBI release 2020-09-01

2 references

adenosine-5'-(N-propyl)carboxamide (English)

19 October 2016

https://commonchemistry.cas.org/detail?cas_rn=57872-80-7

8 April 2021

1 reference

(2S,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxy-N-propyltetrahydro-2-furancarboxamide (English)

19 October 2016

2 references

Adenosine-5'-(N-propyl)carboxamide (English)

matched by identifier from

19 October 2016

ChEBI ID

140261

mapping relation type

2 references

adenosine-5'-(N-propyl)carboxamide (English)

matched by identifier from

19 October 2016

International Chemical Identifier

InChI

InChI=1S/C13H18N6O4/c1-2-3-15-12(22)9-7(20)8(21)13(23-9)19-5-18-6-10(14)16-4-17-11(6)19/h4-5,7-9,13,20-21H,2-3H2,1H3,(H,15,22)(H2,14,16,17)/t7-,8+,9-,13+/m0/s1

1 reference

matched by identifier from

CHEMBL1235128 (English)

19 October 2016

1 reference

1 reference

0 references

1 reference

1U0Y (English)

19 October 2016

1 reference

2GQP (English)