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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H30N2O7
Molecular Weight 374.4293
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TROSPECTOMYCIN

SMILES

[H][C@@]12O[C@H](CCCC)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=KHAUBYTYGDOYRU-IRXASZMISA-N
InChI=1S/C17H30N2O7/c1-4-5-6-8-7-9(20)17(23)16(24-8)25-15-13(22)10(18-2)12(21)11(19-3)14(15)26-17/h8,10-16,18-19,21-23H,4-7H2,1-3H3/t8-,10-,11+,12+,13+,14-,15-,16+,17+/m1/s1

HIDE SMILES / InChI

Molecular Formula C17H30N2O7
Molecular Weight 374.4293
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 16:04:45 UTC 2023
Edited
by admin
on Sat Dec 16 16:04:45 UTC 2023
Record UNII
5S94MC2FRG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TROSPECTOMYCIN
INN   MI   VANDF  
INN  
Official Name English
(2R,4AR,5AR,6S,7S,8R,9S,9AR,10AS)-2-BUTYLDECAHYDRO-4A,7,9-TRIHYDROXY-6,8-BIS(METHYLAMINO)-4H-PYRANO(2,3-B)(1,4)BENZODIOXIN-4-ONE
Common Name English
4H-PYRANO(2,3-B)(1,4)BENZODIOXIN-4-ONE, 2-BUTYLDECAHYDRO-4A,7,9-TRIHYDROXY-6,8-BIS(METHYLAMINO)-, (2R-(2.ALPHA.,4A.BETA.,5A.BETA.,6.BETA.,7.BETA.,8.BETA.,9.ALPHA.,9A.ALPHA.,10A.BETA.))-
Common Name English
TROSPECTINOMYCIN
Common Name English
trospectomycin [INN]
Common Name English
U-63366
Common Name English
TROSPECTOMYCIN [VANDF]
Common Name English
TROSPECTOMYCIN [MI]
Common Name English
U-63,366
Code English
Classification Tree Code System Code
NCI_THESAURUS C2363
Created by admin on Sat Dec 16 16:04:46 UTC 2023 , Edited by admin on Sat Dec 16 16:04:46 UTC 2023
Code System Code Type Description
DRUG CENTRAL
3846
Created by admin on Sat Dec 16 16:04:46 UTC 2023 , Edited by admin on Sat Dec 16 16:04:46 UTC 2023
PRIMARY
EVMPD
SUB11348MIG
Created by admin on Sat Dec 16 16:04:46 UTC 2023 , Edited by admin on Sat Dec 16 16:04:46 UTC 2023
PRIMARY
ChEMBL
CHEMBL1614655
Created by admin on Sat Dec 16 16:04:46 UTC 2023 , Edited by admin on Sat Dec 16 16:04:46 UTC 2023
PRIMARY
PUBCHEM
55886
Created by admin on Sat Dec 16 16:04:46 UTC 2023 , Edited by admin on Sat Dec 16 16:04:46 UTC 2023
PRIMARY
FDA UNII
5S94MC2FRG
Created by admin on Sat Dec 16 16:04:46 UTC 2023 , Edited by admin on Sat Dec 16 16:04:46 UTC 2023
PRIMARY
NCI_THESAURUS
C152769
Created by admin on Sat Dec 16 16:04:46 UTC 2023 , Edited by admin on Sat Dec 16 16:04:46 UTC 2023
PRIMARY
CAS
88669-04-9
Created by admin on Sat Dec 16 16:04:46 UTC 2023 , Edited by admin on Sat Dec 16 16:04:46 UTC 2023
PRIMARY
SMS_ID
100000076981
Created by admin on Sat Dec 16 16:04:46 UTC 2023 , Edited by admin on Sat Dec 16 16:04:46 UTC 2023
PRIMARY
INN
5730
Created by admin on Sat Dec 16 16:04:46 UTC 2023 , Edited by admin on Sat Dec 16 16:04:46 UTC 2023
PRIMARY
MERCK INDEX
m981
Created by admin on Sat Dec 16 16:04:46 UTC 2023 , Edited by admin on Sat Dec 16 16:04:46 UTC 2023
PRIMARY Merck Index
EPA CompTox
DTXSID20869010
Created by admin on Sat Dec 16 16:04:46 UTC 2023 , Edited by admin on Sat Dec 16 16:04:46 UTC 2023
PRIMARY
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SALT/SOLVATE -> PARENT
SALT/SOLVATE -> PARENT
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ACTIVE MOIETY