DEMETHOXYFUMITREMORGIN C

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H23N3O2
Molecular Weight	349.4262
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)=C[C@@H]1N2[C@H](CC3=C1NC4=C3C=CC=C4)C(=O)N5CCC[C@H]5C2=O

InChI

InChIKey=LQXCSIKDOISJTI-OKZBNKHCSA-N

InChI=1S/C21H23N3O2/c1-12(2)10-17-19-14(13-6-3-4-7-15(13)22-19)11-18-20(25)23-9-5-8-16(23)21(26)24(17)18/h3-4,6-7,10,16-18,22H,5,8-9,11H2,1-2H3/t16-,17-,18+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C21H23N3O2
Molecular Weight	349.4262
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 08:03:45 GMT 2025` Edited by `admin` on `Wed Apr 02 08:03:45 GMT 2025`
Record UNII	682ER5CF7O
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DEMETHOXYFUMITREMORGIN C

Common Name

English

DEMETHOXY-12-EPIFUMITREMORGIN C

Preferred Name

English

5H,14H-PYRROLO(1'',2'':4',5')PYRAZINO(1',2':1,6)PYRIDO(3,4-B)INDOLE-5,14-DIONE, 1,2,3,5A,6,11,12,14A-OCTAHYDRO-12-(2-METHYL-1-PROPENYL)-, (5AR-(5A.ALPHA.,12.ALPHA.,14A.BETA.))-

Systematic Name

English

Code System Code Type Description

PUBCHEM

102017149

Created by admin on Wed Apr 02 08:03:45 GMT 2025 , Edited by admin on Wed Apr 02 08:03:45 GMT 2025

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CHEBI

72767

Created by admin on Wed Apr 02 08:03:45 GMT 2025 , Edited by admin on Wed Apr 02 08:03:45 GMT 2025

PRIMARY

FDA UNII

682ER5CF7O

Created by admin on Wed Apr 02 08:03:45 GMT 2025 , Edited by admin on Wed Apr 02 08:03:45 GMT 2025

PRIMARY

CAS

106211-91-0

Created by admin on Wed Apr 02 08:03:45 GMT 2025 , Edited by admin on Wed Apr 02 08:03:45 GMT 2025

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