Filricianine

Details

Stereochemistry	RACEMIC
Molecular Formula	C45H52N2O12S3
Molecular Weight	909.096
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	3
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1(C)C(=CC=C2CCCC(C=CC3=[N+](CCCS([O-])(=O)=O)C4=CC=CC=C4C3(C)CCCC(O)=O)=C2OC5=CC=C(C=C5)S(O)(=O)=O)N(CCCS(O)(=O)=O)C6=CC=CC=C16

InChI

InChIKey=OGIBAYOMUKQFLE-UHFFFAOYSA-N

InChI=1S/C45H52N2O12S3/c1-44(2)36-14-4-6-16-38(36)46(28-10-30-60(50,51)52)40(44)25-19-32-12-8-13-33(43(32)59-34-21-23-35(24-22-34)62(56,57)58)20-26-41-45(3,27-9-18-42(48)49)37-15-5-7-17-39(37)47(41)29-11-31-61(53,54)55/h4-7,14-17,19-26H,8-13,18,27-31H2,1-3H3,(H3-,48,49,50,51,52,53,54,55,56,57,58)

HIDE SMILES / InChI

Molecular Formula	C45H52N2O12S3
Molecular Weight	909.096
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	3
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 21:20:59 GMT 2025` Edited by `admin` on `Wed Apr 02 21:20:59 GMT 2025`
Record UNII	CI4MD9KLX8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3H-Indolium, 3-(3-carboxypropyl)-2-[2-[3-[2-[1,3-dihydro-3,3-dimethyl-1-(3-sulfopropyl)-2H-indol-2-ylidene]ethylidene]-2-(4-sulfophenoxy)-1-cyclohexen-1-yl]ethenyl]-3-methyl-1-(3-sulfopropyl)-, inner salt

Preferred Name

English

Filricianine

Official Name

English

filricianine [INN]

Common Name

English

Code System Code Type Description

FDA UNII

CI4MD9KLX8