U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C11H15N5O4
Molecular Weight 281.2679
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IMMUCILLIN G

SMILES

NC1=NC(=O)C2=C(N1)C(=CN2)[C@@H]3N[C@H](CO)[C@@H](O)[C@H]3O

InChI

InChIKey=KBIDJCVAURJXFG-PVEDRDFWSA-N
InChI=1S/C11H15N5O4/c12-11-15-5-3(1-13-7(5)10(20)16-11)6-9(19)8(18)4(2-17)14-6/h1,4,6,8-9,13-14,17-19H,2H2,(H3,12,15,16,20)/t4-,6+,8-,9+/m1/s1

HIDE SMILES / InChI

Molecular Formula C11H15N5O4
Molecular Weight 281.2679
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 16:26:40 GMT 2023
Edited
by admin
on Sat Dec 16 16:26:40 GMT 2023
Record UNII
XLM0Q9H891
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IMMUCILLIN G
Common Name English
1,4-DIDEOXY-1,4-IMINO-1-(S)-(9-DEAZAGUANIN-9-YL)-D-RIBITOL
Systematic Name English
4H-PYRROLO(3,2-D)PYRIMIDIN-4-ONE, 2-AMINO-7-((2S,3S,4R,5R)-3,4-DIHYDROXY-5-(HYDROXYMETHYL)-2-PYRROLIDINYL)-3,5-DIHYDRO-
Systematic Name English
2-AMINO-7-((2S,3S,4R,5R)-3,4-DIHYDROXY-5-(HYDROXYMETHYL)-2-PYRROLIDINYL)-3,5-DIHYDRO-4H-PYRROLO(3,2-D)PYRIMIDIN-4-ONE
Systematic Name English
Code System Code Type Description
PUBCHEM
135445969
Created by admin on Sat Dec 16 16:26:40 GMT 2023 , Edited by admin on Sat Dec 16 16:26:40 GMT 2023
PRIMARY
CHEBI
43467
Created by admin on Sat Dec 16 16:26:40 GMT 2023 , Edited by admin on Sat Dec 16 16:26:40 GMT 2023
PRIMARY
CAS
209799-75-7
Created by admin on Sat Dec 16 16:26:40 GMT 2023 , Edited by admin on Sat Dec 16 16:26:40 GMT 2023
PRIMARY
FDA UNII
XLM0Q9H891
Created by admin on Sat Dec 16 16:26:40 GMT 2023 , Edited by admin on Sat Dec 16 16:26:40 GMT 2023
PRIMARY