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Details

Stereochemistry ABSOLUTE
Molecular Formula C25H30N2O9
Molecular Weight 502.5137
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HYDRODOLASETRON GLUCURONIDE, R-

SMILES

[H][C@@]12C[C@]3([H])C[C@@H](C[C@]([H])(C1)N3C[C@@H]2O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(O)=O)OC(=O)C5=CNC6=C5C=CC=C6

InChI

InChIKey=AHLHDKGZWOOHBZ-FFCNMTCTSA-N
InChI=1S/C25H30N2O9/c28-19-20(29)22(23(31)32)36-25(21(19)30)35-18-10-27-12-5-11(18)6-13(27)8-14(7-12)34-24(33)16-9-26-17-4-2-1-3-15(16)17/h1-4,9,11-14,18-22,25-26,28-30H,5-8,10H2,(H,31,32)/t11-,12-,13+,14+,18-,19-,20-,21+,22-,25+/m0/s1

HIDE SMILES / InChI

Molecular Formula C25H30N2O9
Molecular Weight 502.5137
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 9 / 10
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:40:43 UTC 2023
Edited
by admin
on Sat Dec 16 09:40:43 UTC 2023
Record UNII
F46LKW7TG6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HYDRODOLASETRON GLUCURONIDE, R-
Common Name English
Code System Code Type Description
CAS
168559-99-7
Created by admin on Sat Dec 16 09:40:43 UTC 2023 , Edited by admin on Sat Dec 16 09:40:43 UTC 2023
PRIMARY
PUBCHEM
91810622
Created by admin on Sat Dec 16 09:40:43 UTC 2023 , Edited by admin on Sat Dec 16 09:40:43 UTC 2023
PRIMARY
FDA UNII
F46LKW7TG6
Created by admin on Sat Dec 16 09:40:43 UTC 2023 , Edited by admin on Sat Dec 16 09:40:43 UTC 2023
PRIMARY
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