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

Details

Stereochemistry ABSOLUTE
Molecular Formula C14H24N2O7.2ClH.5H2O
Molecular Weight 495.348
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SPECTINOMYCIN HYDROCHLORIDE

SMILES

O.O.O.O.O.Cl.Cl.[H][C@@]12O[C@H](C)CC(=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=DCHJOVNPPSBWHK-UXXUFHFZSA-N
InChI=1S/C14H24N2O7.2ClH.5H2O/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;;;;;;;/h5,7-13,15-16,18-20H,4H2,1-3H3;2*1H;5*1H2/t5-,7-,8+,9+,10+,11-,12-,13+,14+;;;;;;;/m1......./s1

HIDE SMILES / InChI
Molecular Formula C14H24N2O7
Molecular Weight 332.3496
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED
Molecular Formula H2O
Molecular Weight 18.0153
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE
Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:04:36 UTC 2023
Edited
by admin
on Fri Dec 15 15:04:36 UTC 2023
Record UNII
HWT06H303Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SPECTINOMYCIN HYDROCHLORIDE
USAN  
Official Name English
SPECTINOMYCIN HYDROCHLORIDE [USAN]
Common Name English
SPECTINOMYCIN HYDROCHLORIDE [USP IMPURITY]
Common Name English
SPECTINOMYCIN DIHYDROCHLORIDE PENTAHYDRATE
EP   GREEN BOOK   MI  
Common Name English
SPECTINOMYCIN HYDROCHLORIDE [VANDF]
Common Name English
NSC-757319
Code English
SPECTINOMYCIN DIHYDROCHLORIDE PENTAHYDRATE [EP MONOGRAPH]
Common Name English
SPECTINOMYCIN HYDROCHLORIDE PENTAHYDRATE
GREEN BOOK   WHO-DD  
Common Name English
SPECTINOMYCIN HYDROCHLORIDE [ORANGE BOOK]
Common Name English
Decahydro-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)-4H-pyrano[2,3-b][1,4]benzodioxin-4-one dihydrochloride pentahydrate
Systematic Name English
SPECTINOMYCIN HYDROCHLORIDE HYDRATE
Common Name English
ACTINOSPECTACIN DIHYDROCHLORIDE PENTAHYDRATE
Common Name English
SPECTINOMYCIN DIHYDROCHLORIDE PENTAHYDRATE [GREEN BOOK]
Common Name English
SPECTINOMYCIN DIHYDROCHLORIDE PENTAHYDRATE [MI]
Common Name English
SPECTINOMYCIN HYDROCHLORIDE PENTAHYDRATE [GREEN BOOK]
Common Name English
ESPECTINOMICINA DIHYDROCHLORIDE PENTAHYDRATE
Common Name English
SPECTINOMYCIN DIHYDROCHLORIDE PENTAHYDRATE [EP IMPURITY]
Common Name English
SPECTINOMYCIN HYDROCHLORIDE HYDRATE [JAN]
Common Name English
(2R-(2.ALPHA.,4A.BETA.,5A.BETA.,6.BETA.,7.BETA.,8.BETA.,9.ALPHA.,9A.ALPHA.,10A.BETA.))-DECAHYDRO-4A,7,9-TRIHYDROXY-2-METHYL-6,8-BIS(METHYLAMINO)-4H-PYRANO(2,3-B)(1,4)BENZODIOXIN-4-ONE DIHYDROCHLORIDE PENTAHYDRATE
Common Name English
SPECTINOMYCIN HYDROCHLORIDE [USP MONOGRAPH]
Common Name English
SPECTINOMYCIN HCL
Common Name English
SPECTINOMYCIN HYDROCHLORIDE [USP-RS]
Common Name English
SPECTINOMYCIN HCL PENTAHYDRATE
Common Name English
M-141
Code English
4H-PYRANO(2,3-B)(1,4)BENZODIOXIN-4-ONE, DECAHYDRO-4A,7,9-TRIHYDROXY-2-METHYL-6,8-BIS(METHYLAMINO)-, DIHYDROCHLORIDE, PENTAHYDRATE
Systematic Name English
U-18409AE
Code English
SPECTINOMYCINI HYDROCHLORIDUM [WHO-IP LATIN]
Common Name English
Spectinomycin hydrochloride pentahydrate [WHO-DD]
Common Name English
4H-PYRANO(2,3-B)(1,4)BENZODIOXIN-4-ONE, DECAHYDRO-4A,7,9-TRIHYDROXY-2-METHYL-6,8-BIS(METHYLAMINO)-, HYDROCHLORIDE, HYDRATE (1:2:5), (2R,4AR,5AR,6S,7S,8R,9S,9AR,10AS)-
Common Name English
U-18,409AE
Code English
Classification Tree Code System Code
NCI_THESAURUS C2363
Created by admin on Fri Dec 15 15:04:37 UTC 2023 , Edited by admin on Fri Dec 15 15:04:37 UTC 2023
Code System Code Type Description
RS_ITEM_NUM
1618003
Created by admin on Fri Dec 15 15:04:37 UTC 2023 , Edited by admin on Fri Dec 15 15:04:37 UTC 2023
PRIMARY
EVMPD
SUB12327MIG
Created by admin on Fri Dec 15 15:04:37 UTC 2023 , Edited by admin on Fri Dec 15 15:04:37 UTC 2023
PRIMARY
SMS_ID
100000084957
Created by admin on Fri Dec 15 15:04:37 UTC 2023 , Edited by admin on Fri Dec 15 15:04:37 UTC 2023
PRIMARY
DAILYMED
HWT06H303Z
Created by admin on Fri Dec 15 15:04:37 UTC 2023 , Edited by admin on Fri Dec 15 15:04:37 UTC 2023
PRIMARY
EPA CompTox
DTXSID90944843
Created by admin on Fri Dec 15 15:04:37 UTC 2023 , Edited by admin on Fri Dec 15 15:04:37 UTC 2023
PRIMARY
MERCK INDEX
m10136
Created by admin on Fri Dec 15 15:04:37 UTC 2023 , Edited by admin on Fri Dec 15 15:04:37 UTC 2023
PRIMARY Merck Index
EVMPD
SUB04522MIG
Created by admin on Fri Dec 15 15:04:37 UTC 2023 , Edited by admin on Fri Dec 15 15:04:37 UTC 2023
PRIMARY
CHEBI
9217
Created by admin on Fri Dec 15 15:04:37 UTC 2023 , Edited by admin on Fri Dec 15 15:04:37 UTC 2023
PRIMARY
WIKIPEDIA
Spectinomycin hydrochloride
Created by admin on Fri Dec 15 15:04:37 UTC 2023 , Edited by admin on Fri Dec 15 15:04:37 UTC 2023
PRIMARY
PUBCHEM
30971
Created by admin on Fri Dec 15 15:04:37 UTC 2023 , Edited by admin on Fri Dec 15 15:04:37 UTC 2023
PRIMARY
CHEBI
9216
Created by admin on Fri Dec 15 15:04:37 UTC 2023 , Edited by admin on Fri Dec 15 15:04:37 UTC 2023
PRIMARY
ChEMBL
CHEMBL1167
Created by admin on Fri Dec 15 15:04:37 UTC 2023 , Edited by admin on Fri Dec 15 15:04:37 UTC 2023
PRIMARY
NSC
757319
Created by admin on Fri Dec 15 15:04:37 UTC 2023 , Edited by admin on Fri Dec 15 15:04:37 UTC 2023
PRIMARY
RXCUI
267342
Created by admin on Fri Dec 15 15:04:37 UTC 2023 , Edited by admin on Fri Dec 15 15:04:37 UTC 2023
PRIMARY RxNorm
FDA UNII
HWT06H303Z
Created by admin on Fri Dec 15 15:04:37 UTC 2023 , Edited by admin on Fri Dec 15 15:04:37 UTC 2023
PRIMARY
CAS
22189-32-8
Created by admin on Fri Dec 15 15:04:37 UTC 2023 , Edited by admin on Fri Dec 15 15:04:37 UTC 2023
PRIMARY
DRUG BANK
DBSALT001630
Created by admin on Fri Dec 15 15:04:37 UTC 2023 , Edited by admin on Fri Dec 15 15:04:37 UTC 2023
PRIMARY
NCI_THESAURUS
C47728
Created by admin on Fri Dec 15 15:04:37 UTC 2023 , Edited by admin on Fri Dec 15 15:04:37 UTC 2023
PRIMARY
WHO INTERNATIONAL PHARMACOPEIA
SPECTINOMYCIN HYDROCHLORIDE
Created by admin on Fri Dec 15 15:04:37 UTC 2023 , Edited by admin on Fri Dec 15 15:04:37 UTC 2023
PRIMARY Description: A white or almost white, crystalline powder; odourless. Solubility: Freely soluble in water; practically insoluble in ethanol (~750 g/l) TS and ether R. Category: Antibacterial drug. Storage: Spectinomycin hydrochloride should be kept in a well-closed container. Definition: Spectinomycin hydrochloride contains not less than 600 .MU.g of C14H24N2O7 per mg, calculated with reference to the anhydrous substance. Manufacture: The method of manufacture is validated to demonstrate that the product, if tested, would comply with the following test. Histamine-like substances. Carry out the test as described under 3.6 Test for histamine-like substances (vasodepressor substances) using 1 mL per kg of body mass of a solution in saline TS containing 25 mg of the substance to be examined per mL.
Related Record Type Details
Structure of SPECTINOMYCIN
PARENT -> SALT/SOLVATE
Structure of SPECTINOMYCIN HYDROCHLORIDE ANHYDROUS
ANHYDROUS->SOLVATE
Related Record Type Details
Structure of (4S)-DIHYDROSPECTINOMYCIN
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Structure of TETRAHYDROXYSPECTINOMYCIN
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Structure of Triol spectinomycin
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Structure of N-DESMETHYLSPECTINOMYCIN
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Structure of DIHYDROXYSPECTINOMYCIN
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Related Record Type Details
Structure of SPECTINOMYCIN
ACTIVE MOIETY
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966