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

Details

Stereochemistry ABSOLUTE
Molecular Formula C15H21N3O15
Molecular Weight 483.3383
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of KARAKIN

SMILES

O[C@H]1[C@H](O)[C@@H](OC(=O)CC[N+]([O-])=O)[C@H](OC(=O)CC[N+]([O-])=O)O[C@@H]1COC(=O)CC[N+]([O-])=O

InChI

InChIKey=CNURKUNYCXCBEK-WMNSZERYSA-N
InChI=1S/C15H21N3O15/c19-9(1-4-16(24)25)30-7-8-12(22)13(23)14(32-10(20)2-5-17(26)27)15(31-8)33-11(21)3-6-18(28)29/h8,12-15,22-23H,1-7H2/t8-,12-,13+,14-,15+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
KARAKIN
Common Name English
.BETA.-D-GLUCOPYRANOSE 1,2,6-TRI(3-NITROPROPANOATE)
Systematic Name English
((2R,3S,4S,5R,6S)-3,4-DIHYDROXY-5,6-BIS(3-NITROPROPANOYLOXY)OXAN-2-YL)METHYL 3-NITROPROPANOATE
Systematic Name English
NSC-279515
Code English
BETA-D-GLUCOPYRANOSE, 1,2,6-TRIS(3-NITROPROPANOATE)
Common Name English
C08495
Code English
.BETA.-D-GLUCOPYRANOSE, 1,2,6-TRIS(3-NITROPROPANOATE)
Systematic Name English
J92.792I
Code English
ENDECAPHILLIN A
Common Name English
1,2,6-TRIS-O-(3-NITROPROPANOYL)-.BETA.-D-GLUCOPYRANOSE
Systematic Name English
1-O,2-O,6-O-TRIS(3-NITROPROPANOYL)-.BETA.-D-GLUCOPYRANOSE
Common Name English
CARAKIN
Common Name English
Code System Code Type Description
FDA UNII
I84581BGZY
Created by admin on Sat Dec 16 08:03:31 GMT 2023 , Edited by admin on Sat Dec 16 08:03:31 GMT 2023
PRIMARY
CAS
1400-11-9
Created by admin on Sat Dec 16 08:03:31 GMT 2023 , Edited by admin on Sat Dec 16 08:03:31 GMT 2023
PRIMARY
EPA CompTox
DTXSID40930690
Created by admin on Sat Dec 16 08:03:31 GMT 2023 , Edited by admin on Sat Dec 16 08:03:31 GMT 2023
PRIMARY
PUBCHEM
100274
Created by admin on Sat Dec 16 08:03:31 GMT 2023 , Edited by admin on Sat Dec 16 08:03:31 GMT 2023
PRIMARY
NSC
279515
Created by admin on Sat Dec 16 08:03:31 GMT 2023 , Edited by admin on Sat Dec 16 08:03:31 GMT 2023
PRIMARY