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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H35N9O15P2
Molecular Weight 715.5014
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ADP-RIBOSYLARGININE

SMILES

N[C@@H](CCCNC(=N)N[C@H]1O[C@H](COP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)N3C=NC4=C(N)N=CN=C34)[C@@H](O)[C@H]1O)C(O)=O

InChI

InChIKey=IWVSYNGKNZFSSA-PTDVUUCPSA-N
InChI=1S/C21H35N9O15P2/c22-8(20(35)36)2-1-3-25-21(24)29-18-14(33)12(31)9(43-18)4-41-46(37,38)45-47(39,40)42-5-10-13(32)15(34)19(44-10)30-7-28-11-16(23)26-6-27-17(11)30/h6-10,12-15,18-19,31-34H,1-5,22H2,(H,35,36)(H,37,38)(H,39,40)(H2,23,26,27)(H3,24,25,29)/t8-,9+,10+,12+,13+,14+,15+,18-,19+/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H35N9O15P2
Molecular Weight 715.5014
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:08:03 GMT 2023
Edited
by admin
on Sat Dec 16 12:08:03 GMT 2023
Record UNII
D5024CP23U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ADP-RIBOSYLARGININE
Common Name English
.ALPHA.-ADP-RIBOSYLARGININE
Common Name English
L-ORNITHINE, N5-(((5-O-(HYDROXY(PHOSPHONOOXY)PHOSPHINYL)-.ALPHA.-D-RIBOFURANOSYL)AMINO)IMINOMETHYL)-, P'->5'-ESTER WITH ADENOSINE
Common Name English
L-ORNITHINE, N5-(IMINO(.ALPHA.-D-RIBOFURANOSYLAMINO)METHYL)-, (5'->P')-ESTER WITH ADENOSINE 5'-(TRIHYDROGEN DIPHOSPHATE)
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID801107506
Created by admin on Sat Dec 16 12:08:03 GMT 2023 , Edited by admin on Sat Dec 16 12:08:03 GMT 2023
PRIMARY
CAS
103960-56-1
Created by admin on Sat Dec 16 12:08:03 GMT 2023 , Edited by admin on Sat Dec 16 12:08:03 GMT 2023
PRIMARY
PUBCHEM
46173712
Created by admin on Sat Dec 16 12:08:03 GMT 2023 , Edited by admin on Sat Dec 16 12:08:03 GMT 2023
PRIMARY
FDA UNII
D5024CP23U
Created by admin on Sat Dec 16 12:08:03 GMT 2023 , Edited by admin on Sat Dec 16 12:08:03 GMT 2023
PRIMARY