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Details

Stereochemistry EPIMERIC
Molecular Formula C39H30N8O15
Molecular Weight 850.7001
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TLC-388

SMILES

CC[C@@]4(OC(=O)C(C)ON=C1C2=C(C3=C1C=C(C=C3[N+]([O-])=O)[N+]([O-])=O)C(=CC(=C2)[N+]([O-])=O)[N+]([O-])=O)C(=O)OCC5=C4C=C6N(CC7=C6N=C8C=CC(O)=C(CN(C)C)C8=C7)C5=O

InChI

InChIKey=JCCCLGDYMMTBPM-HXDHBHDHSA-N
InChI=1S/C39H30N8O15/c1-5-39(26-13-30-34-18(14-43(30)36(49)25(26)16-60-38(39)51)8-21-24(15-42(3)4)31(48)7-6-27(21)40-34)61-37(50)17(2)62-41-35-22-9-19(44(52)53)11-28(46(56)57)32(22)33-23(35)10-20(45(54)55)12-29(33)47(58)59/h6-13,17,48H,5,14-16H2,1-4H3/t17?,39-/m0/s1

HIDE SMILES / InChI

Molecular Formula C39H30N8O15
Molecular Weight 850.7001
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 1 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 05:33:50 UTC 2023
Edited
by admin
on Sat Dec 16 05:33:50 UTC 2023
Record UNII
D47234N30N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TLC-388
Common Name English
PROPANOIC ACID, 2-(((2,4,5,7-TETRANITRO-9H-FLUOREN-9-YLIDENE)AMINO)OXY)-, (4S)-10-((DIMETHYLAMINO)METHYL)-4-ETHYL-3,4,12,14-TETRAHYDRO-9-HYDROXY-3,14-DIOXO-1H-PYRANO(3',4':6,7)INDOLIZINO(1,2-B)QUINOLIN-4-YL ESTER
Systematic Name English
LIPOTHECAN FREE BASE
Common Name English
LIPOTECAN
Common Name English
Classification Tree Code System Code
EU-Orphan Drug EU/3/10/788
Created by admin on Sat Dec 16 05:33:50 UTC 2023 , Edited by admin on Sat Dec 16 05:33:50 UTC 2023
FDA ORPHAN DRUG 317610
Created by admin on Sat Dec 16 05:33:50 UTC 2023 , Edited by admin on Sat Dec 16 05:33:50 UTC 2023
Code System Code Type Description
PUBCHEM
46871946
Created by admin on Sat Dec 16 05:33:50 UTC 2023 , Edited by admin on Sat Dec 16 05:33:50 UTC 2023
PRIMARY
CAS
1432468-79-5
Created by admin on Sat Dec 16 05:33:50 UTC 2023 , Edited by admin on Sat Dec 16 05:33:50 UTC 2023
PRIMARY
EVMPD
SUB195032
Created by admin on Sat Dec 16 05:33:50 UTC 2023 , Edited by admin on Sat Dec 16 05:33:50 UTC 2023
PRIMARY
SMS_ID
100000181070
Created by admin on Sat Dec 16 05:33:50 UTC 2023 , Edited by admin on Sat Dec 16 05:33:50 UTC 2023
PRIMARY
FDA UNII
D47234N30N
Created by admin on Sat Dec 16 05:33:50 UTC 2023 , Edited by admin on Sat Dec 16 05:33:50 UTC 2023
PRIMARY
NCI_THESAURUS
C80047
Created by admin on Sat Dec 16 05:33:50 UTC 2023 , Edited by admin on Sat Dec 16 05:33:50 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY