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Details

Stereochemistry ABSOLUTE
Molecular Formula C11H15N5O8P2
Molecular Weight 407.213
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CARBOVIR DIPHOSPHATE, (-)-

SMILES

NC1=NC2=C(N=CN2[C@@H]3C[C@H](COP(O)(=O)OP(O)(O)=O)C=C3)C(=O)N1

InChI

InChIKey=LBDJPXUIKREEKI-RQJHMYQMSA-N
InChI=1S/C11H15N5O8P2/c12-11-14-9-8(10(17)15-11)13-5-16(9)7-2-1-6(3-7)4-23-26(21,22)24-25(18,19)20/h1-2,5-7H,3-4H2,(H,21,22)(H2,18,19,20)(H3,12,14,15,17)/t6-,7+/m1/s1

HIDE SMILES / InChI

Molecular Formula C11H15N5O8P2
Molecular Weight 407.213
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:39:06 GMT 2023
Edited
by admin
on Sat Dec 16 08:39:06 GMT 2023
Record UNII
6U905D25FD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CARBOVIR DIPHOSPHATE, (-)-
Common Name English
DIPHOSPHORIC ACID, MONO(((1S,4R)-4-(2-AMINO-1,6-DIHYDRO-6-OXO-9H-PURIN-9-YL)-2-CYCLOPENTEN-1-YL)METHYL) ESTER
Systematic Name English
DIPHOSPHORIC ACID, MONO((4-(2-AMINO-1,6-DIHYDRO-6-OXO-9H-PURIN-9-YL)-2-CYCLOPENTEN-1-YL)METHYL) ESTER, (1S-CIS)-
Systematic Name English
(-)-CARBOVIR DIPHOSPHATE
Common Name English
Code System Code Type Description
CHEBI
64172
Created by admin on Sat Dec 16 08:39:06 GMT 2023 , Edited by admin on Sat Dec 16 08:39:06 GMT 2023
PRIMARY
CAS
129895-89-2
Created by admin on Sat Dec 16 08:39:06 GMT 2023 , Edited by admin on Sat Dec 16 08:39:06 GMT 2023
PRIMARY
FDA UNII
6U905D25FD
Created by admin on Sat Dec 16 08:39:06 GMT 2023 , Edited by admin on Sat Dec 16 08:39:06 GMT 2023
PRIMARY
PUBCHEM
135564825
Created by admin on Sat Dec 16 08:39:06 GMT 2023 , Edited by admin on Sat Dec 16 08:39:06 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE ACTIVE