ROQUEFORTINE C

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H23N5O2
Molecular Weight	389.4503
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12C[C@]3(C4=CC=CC=C4N[C@@]3([H])N1C(=O)\C(NC2=O)=C/C5=CNC=N5)C(C)(C)C=C

InChI

InChIKey=SPWSUFUPTSJWNG-JJUKSXGLSA-N

InChI=1S/C22H23N5O2/c1-4-21(2,3)22-10-17-18(28)25-16(9-13-11-23-12-24-13)19(29)27(17)20(22)26-15-8-6-5-7-14(15)22/h4-9,11-12,17,20,26H,1,10H2,2-3H3,(H,23,24)(H,25,28)/b16-9+/t17-,20-,22+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C22H23N5O2
Molecular Weight	389.4503
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 19:50:46 UTC 2023` Edited by `admin` on `Fri Dec 15 19:50:46 UTC 2023`
Record UNII	4VW6U94XFK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ROQUEFORTINE C

Common Name

English

ROQUEFORTINE

Common Name

English

2H-PYRAZINO(1',2':1,5)PYRROLO(2,3-B)INDOLE-1,4(3H,5AH)-DIONE, 10B-(1,1-DIMETHYL-2-PROPEN-1-YL)-6,10B,11,11A-TETRAHYDRO-3-(1H-IMIDAZOL-5-YLMETHYLENE)-, (3E,5AS,10BR,11AS)-

Common Name

English

NSC-292134

Code

English

ROQUEFORTIN

Common Name

English

2H-PYRAZINO(1',2':1,5)PYRROLO(2,3-B)INDOLE-1,4(3H,5AH)-DIONE, 10B-(1,1-DIMETHYL-2-PROPENYL)-6,10B,11,11A-TETRAHYDRO-3-(1H-IMIDAZOL-4-YLMETHYLENE)-, (3E,5AS,10BR,11AS)-

Common Name

English

(-)-ROQUEFORTINE C

Common Name

English

ROQUEFORTINE [HSDB]

Common Name

English

Code System Code Type Description

NSC

292134