MELITRACEN METHANESULFONATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H25N.CH4O3S
Molecular Weight	387.536
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of MELITRACEN METHANESULFONATE

Structure Search

SMILES

CS(O)(=O)=O.CN(C)CCC=C1C2=C(C=CC=C2)C(C)(C)C3=C1C=CC=C3

InChI

InChIKey=LXKCTBYAJVUILB-UHFFFAOYSA-N

InChI=1S/C21H25N.CH4O3S/c1-21(2)19-13-7-5-10-17(19)16(12-9-15-22(3)4)18-11-6-8-14-20(18)21;1-5(2,3)4/h5-8,10-14H,9,15H2,1-4H3;1H3,(H,2,3,4)

HIDE SMILES / InChI

Molecular Formula	C21H25N
Molecular Weight	291.4299
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	CH4O3S
Molecular Weight	96.106
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:20:16 UTC 2023` Edited by `admin` on `Sat Dec 16 08:20:16 UTC 2023`
Record UNII	HS8YY1BM7I
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MELITRACEN METHANESULFONATE

Common Name

English

.DELTA.9(10H),.GAMMA.-ANTHRACENEPROPYLAMINE, N,N,10,10-TETRAMETHYL-, METHANESULFONATE

Common Name

English

MELITRACEN MESYLATE

Common Name

English

1-PROPANAMINE, 3-(10,10-DIMETHYL-9(10H)-ANTHRACENYLIDENE)-N,N-DIMETHYL-, METHANESULFONATE (1:1)

Systematic Name

English

1-PROPANAMINE, 3-(10,10-DIMETHYL-9(10H)-ANTHRACENYLIDENE)-N,N-DIMETHYL-, METHANESULFONATE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID40185082

Created by admin on Sat Dec 16 08:20:17 UTC 2023 , Edited by admin on Sat Dec 16 08:20:17 UTC 2023

PRIMARY

CAS

31149-47-0

Created by admin on Sat Dec 16 08:20:17 UTC 2023 , Edited by admin on Sat Dec 16 08:20:17 UTC 2023

PRIMARY

PUBCHEM

53447046

Created by admin on Sat Dec 16 08:20:17 UTC 2023 , Edited by admin on Sat Dec 16 08:20:17 UTC 2023

PRIMARY

FDA UNII

HS8YY1BM7I

Created by admin on Sat Dec 16 08:20:17 UTC 2023 , Edited by admin on Sat Dec 16 08:20:17 UTC 2023

PRIMARY

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