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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H26N2O7
Molecular Weight 334.3654
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (4S)-DIHYDROSPECTINOMYCIN

SMILES

[H][C@@]12O[C@H](C)C[C@H](O)[C@]1(O)O[C@]3([H])[C@@H](NC)[C@@H](O)[C@@H](NC)[C@H](O)[C@@]3([H])O2

InChI

InChIKey=GKPRKJXOTBXASY-AUBRERTDSA-N
InChI=1S/C14H26N2O7/c1-5-4-6(17)14(20)13(21-5)22-12-10(19)7(15-2)9(18)8(16-3)11(12)23-14/h5-13,15-20H,4H2,1-3H3/t5-,6+,7-,8+,9+,10+,11-,12-,13+,14+/m1/s1

HIDE SMILES / InChI

Molecular Formula C14H26N2O7
Molecular Weight 334.3654
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 18:25:31 GMT 2023
Edited
by admin
on Sat Dec 16 18:25:31 GMT 2023
Record UNII
3REK2Z4CBK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(4S)-DIHYDROSPECTINOMYCIN
Common Name English
SPECTINOMYCIN DIHYDROCHLORIDE PENTAHYDRATE IMPURITY C [EP IMPURITY]
Common Name English
(2.ALPHA.,4.ALPHA.,4A.BETA.,5A.BETA.,6.BETA.,7.BETA.,8.BETA.,9.ALPHA.,9A.ALPHA.,10A.BETA.)-OCTAHYDRO-2-METHYL-6,8-BIS(METHYLAMINO)-2H-PYRANO(2,3-B)(1,4)BENZODIOXIN-4,4A,7,9(10AH)-TETROL
Systematic Name English
(2R,4S,4AS,5AR,6S,7S,8R,9S,9AR,10AS)-2-METHYL-6,8-BIS(METHYLAMINO)DECAHYDRO-2H-PYRANO(2,3-B)(1,4)BENZODIOXINE-4,4A,7,9-TETROL
Systematic Name English
2H-PYRANO(2,3-B)(1,4)BENZODIOXIN-4,4A,7,9(10AH)-TETROL, OCTAHYDRO-2-METHYL-6,8-BIS(METHYLAMINO)-, (2.ALPHA.,4.ALPHA.,4A.BETA.,5A.BETA.,6.BETA.,7.BETA.,8.BETA.,9.ALPHA.,9A.ALPHA.,10A.BETA.)-
Systematic Name English
Code System Code Type Description
FDA UNII
3REK2Z4CBK
Created by admin on Sat Dec 16 18:25:31 GMT 2023 , Edited by admin on Sat Dec 16 18:25:31 GMT 2023
PRIMARY
PUBCHEM
25001797
Created by admin on Sat Dec 16 18:25:31 GMT 2023 , Edited by admin on Sat Dec 16 18:25:31 GMT 2023
PRIMARY
CAS
63393-23-7
Created by admin on Sat Dec 16 18:25:31 GMT 2023 , Edited by admin on Sat Dec 16 18:25:31 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP