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Details

Stereochemistry RACEMIC
Molecular Formula C37H42N4O2.2Cl.Sn
Molecular Weight 764.371
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge -4

SHOW SMILES / InChI
Structure of ROSTAPORFIN

SMILES

[Cl-].[Cl-].[SnH4].CCOC(=O)C1=CC2=C3[N-]C(=CC4=NC(=CC5=C(CC)C(C)=C([N-]5)C=C6N=C2C(C)=C6CC)C(C)=C4CC)[C@@H](C)[C@]13CC

InChI

InChIKey=DILGWZXJUXYRHF-QNVJIRAVSA-K
InChI=1S/C37H43N4O2.2ClH.Sn.2H/c1-10-23-19(6)29-17-33-25(12-3)21(8)34(40-33)26-15-27(36(42)43-14-5)37(13-4)22(9)30(41-35(26)37)18-32-24(11-2)20(7)28(39-32)16-31(23)38-29;;;;;/h15-18,22H,10-14H2,1-9H3,(H-,38,39,40,41,42);2*1H;;;/q-1;;;;;/p-3/t22-,37-;;;;;/m1...../s1

HIDE SMILES / InChI

Molecular Formula Cl
Molecular Weight 35.453
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Sn
Molecular Weight 118.71
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C37H42N4O2
Molecular Weight 574.755
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:39:51 UTC 2023
Edited
by admin
on Fri Dec 15 15:39:51 UTC 2023
Record UNII
466G63QE7G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ROSTAPORFIN
INN   MART.   MI   USAN  
INN   USAN  
Official Name English
ROSTAPORFIN [USAN]
Common Name English
rostaporfin [INN]
Common Name English
PHOTREX
Brand Name English
(OC-6-13)-DICHLORO(REL-ETHYL(18R,19S)-3,4,20,21-TETRADEHYDRO-4,9,14,19-TETRAETHYL-18,19-DIHYDRO-3,8,13,18-TETRAMETHYL-20-PHORBINECARBOXYLATO(2-)-.KAPPA.N(SUP 23), .KAPPA.N(SUP 24), .KAPPA.N(SUP 25), .KAPPA.N(SUP 26))TIN
Common Name English
TIN, DICHLORO(REL-ETHYL (18R,19S)-3,4,20,21-TETRADEHYDRO-4,9,14,19-TETRAETHYL-18,19-DIHYDRO-3,8,13,18-TETRAMETHYL-20-PHORBINECARBOXYLATO(2-)-.KAPPA.N23,.KAPPA.N24,.KAPPA.N25,.KAPPA.N26)-, (OC-6-13)-
Systematic Name English
ROSTAPORFIN [MI]
Common Name English
PURLYTIN
Brand Name English
TIN ETHYL ETIOPURPURIN
Common Name English
SNET-2
Code English
ROSTAPORFIN [MART.]
Common Name English
SNET2
Code English
TIN, DICHLORO(REL-ETHYL(18R,19S)-3,4,20,21-TETRADEHYDRO-4,9,14,19-TETRAETHYL-18,19-DIHYDRO-3,8,13,18-TETRAMETHYL-20-PHORBINECARBOXYLATO(2-)-.KAPPA.-N(SUP 23),-.KAPPA.-N(SUP 24),-.KAPPA.-N(SUP 25),-.KAPPA.-N(SUP 26))-, (OC-6-13)-
Common Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 168703
Created by admin on Fri Dec 15 15:39:51 UTC 2023 , Edited by admin on Fri Dec 15 15:39:51 UTC 2023
FDA ORPHAN DRUG 620517
Created by admin on Fri Dec 15 15:39:51 UTC 2023 , Edited by admin on Fri Dec 15 15:39:51 UTC 2023
NCI_THESAURUS C1420
Created by admin on Fri Dec 15 15:39:51 UTC 2023 , Edited by admin on Fri Dec 15 15:39:51 UTC 2023
Code System Code Type Description
NCI_THESAURUS
C171132
Created by admin on Fri Dec 15 15:39:51 UTC 2023 , Edited by admin on Fri Dec 15 15:39:51 UTC 2023
PRIMARY
SMS_ID
300000034364
Created by admin on Fri Dec 15 15:39:51 UTC 2023 , Edited by admin on Fri Dec 15 15:39:51 UTC 2023
PRIMARY
INN
7966
Created by admin on Fri Dec 15 15:39:51 UTC 2023 , Edited by admin on Fri Dec 15 15:39:51 UTC 2023
PRIMARY
FDA UNII
466G63QE7G
Created by admin on Fri Dec 15 15:39:51 UTC 2023 , Edited by admin on Fri Dec 15 15:39:51 UTC 2023
PRIMARY
CAS
284041-10-7
Created by admin on Fri Dec 15 15:39:51 UTC 2023 , Edited by admin on Fri Dec 15 15:39:51 UTC 2023
PRIMARY
MERCK INDEX
m9671
Created by admin on Fri Dec 15 15:39:51 UTC 2023 , Edited by admin on Fri Dec 15 15:39:51 UTC 2023
PRIMARY Merck Index
DRUG BANK
DB06659
Created by admin on Fri Dec 15 15:39:51 UTC 2023 , Edited by admin on Fri Dec 15 15:39:51 UTC 2023
PRIMARY
MESH
C063166
Created by admin on Fri Dec 15 15:39:51 UTC 2023 , Edited by admin on Fri Dec 15 15:39:51 UTC 2023
PRIMARY
USAN
KK-52
Created by admin on Fri Dec 15 15:39:51 UTC 2023 , Edited by admin on Fri Dec 15 15:39:51 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY