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Details

Stereochemistry ABSOLUTE
Molecular Formula C32H44IN2O12P
Molecular Weight 802.5773
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RISAD-P I-123

SMILES

[H][C@@]12CC[C@H](OC(=O)CCC(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(O)=O)N4C=C([123I])C(=O)NC4=O)[C@@]1(C)CC[C@@]5([H])[C@@]2([H])CC[C@@]6([H])CC(=O)CC[C@]56C

InChI

InChIKey=QYYKQPBRFARZNN-DDHXTVLXSA-N
InChI=1S/C32H44IN2O12P/c1-31-11-9-18(36)13-17(31)3-4-19-20-5-6-25(32(20,2)12-10-21(19)31)47-28(38)8-7-27(37)46-23-14-26(45-24(23)16-44-48(41,42)43)35-15-22(33)29(39)34-30(35)40/h15,17,19-21,23-26H,3-14,16H2,1-2H3,(H,34,39,40)(H2,41,42,43)/t17-,19-,20-,21-,23-,24+,25-,26+,31-,32-/m0/s1/i33-4

HIDE SMILES / InChI

Molecular Formula C32H44IN2O12P
Molecular Weight 802.5773
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 10 / 10
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:02:41 GMT 2023
Edited
by admin
on Sat Dec 16 15:02:41 GMT 2023
Record UNII
3CK08OJ3VC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RISAD-P I-123
Common Name English
(123I)-RISAD-P
Common Name English
5'-URIDYLIC ACID, 2'-DEOXY-5-(IODO-123I)-, 3'-ESTER WITH (5.ALPHA.,17.BETA.)-17-(3-CARBOXY-1-OXOPROPOXY)ANDROSTAN-3-ONE
Common Name English
5-(123)IODINE-3'-O(17.BETA.SUCCINYL-5-.ALPHA.ANDROSTAN-3-ONE)-2'-DEOXYURIDIN5YL PHOSPHATE
Systematic Name English
Code System Code Type Description
PUBCHEM
138059655
Created by admin on Sat Dec 16 15:02:41 GMT 2023 , Edited by admin on Sat Dec 16 15:02:41 GMT 2023
PRIMARY
CAS
1905408-58-3
Created by admin on Sat Dec 16 15:02:41 GMT 2023 , Edited by admin on Sat Dec 16 15:02:41 GMT 2023
PRIMARY
FDA UNII
3CK08OJ3VC
Created by admin on Sat Dec 16 15:02:41 GMT 2023 , Edited by admin on Sat Dec 16 15:02:41 GMT 2023
PRIMARY
Related Record Type Details
NON-LABELED -> LABELED