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Details

Stereochemistry EPIMERIC
Molecular Formula C20H23BrN3O8P
Molecular Weight 544.29
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of STAMPIDINE

SMILES

Cc1cn([C@@]2([H])C=C[C@@]([H])(COP(=O)(N[C@]([H])(C)C(=O)OC)Oc3ccc(cc3)Br)O2)c(=O)nc1O

InChI

InChIKey=VPABMVYNSQRPBD-AOJMVMDXSA-N
InChI=1S/C20H23BrN3O8P/c1-12-10-24(20(27)22-18(12)25)17-9-8-16(31-17)11-30-33(28,23-13(2)19(26)29-3)32-15-6-4-14(21)5-7-15/h4-10,13,16-17H,11H2,1-3H3,(H,23,28)(H,22,25,27)/t13-,16+,17-,33?/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H23BrN3O8P
Molecular Weight 544.29
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 01:28:25 UTC 2021
Edited
by admin
on Sat Jun 26 01:28:25 UTC 2021
Record UNII
MHN9I3MQ1X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
STAMPIDINE
Common Name English
HI-113
Code English
SAMPIDINE
Brand Name English
L-ALANINE, N-(P-(4-BROMOPHENYL)-2',3'-DIDEHYDRO-3'-DEOXY-5'-THYMIDYLYL)-, METHYL ESTER
Systematic Name English
Code System Code Type Description
FDA UNII
MHN9I3MQ1X
Created by admin on Sat Jun 26 01:28:25 UTC 2021 , Edited by admin on Sat Jun 26 01:28:25 UTC 2021
PRIMARY
PUBCHEM
469782
Created by admin on Sat Jun 26 01:28:25 UTC 2021 , Edited by admin on Sat Jun 26 01:28:25 UTC 2021
PRIMARY
WIKIPEDIA
Stampidine
Created by admin on Sat Jun 26 01:28:25 UTC 2021 , Edited by admin on Sat Jun 26 01:28:25 UTC 2021
PRIMARY
CAS
217178-62-6
Created by admin on Sat Jun 26 01:28:25 UTC 2021 , Edited by admin on Sat Jun 26 01:28:25 UTC 2021
PRIMARY
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TARGET ORGANISM->INHIBITOR
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METABOLITE ACTIVE -> PARENT
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