KR-31761

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H30N2O9
Molecular Weight	502.5137
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCOC(=O)[C@@H]1CC2=C(C=CC(OC)=C2)N1[C@H]3[C@H](O)[C@@](C)(OC4=CC=C(C=C34)[N+]([O-])=O)C(OC)OC

InChI

InChIKey=CISBCFGQBSPUQB-XIXAVDCQSA-N

InChI=1S/C25H30N2O9/c1-6-35-23(29)19-12-14-11-16(32-3)8-9-18(14)26(19)21-17-13-15(27(30)31)7-10-20(17)36-25(2,22(21)28)24(33-4)34-5/h7-11,13,19,21-22,24,28H,6,12H2,1-5H3/t19-,21+,22-,25+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C25H30N2O9
Molecular Weight	502.5137
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 11:26:06 GMT 2025` Edited by `admin` on `Wed Apr 02 11:26:06 GMT 2025`
Record UNII	EWB3SK7WEH
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

KR-31761

Code

English

1H-INDOLE-2-CARBOXYLIC ACID, 1-((2R,3S,4R)-2-(DIMETHOXYMETHYL)-3,4-DIHYDRO-3-HYDROXY-2-METHYL-6-NITRO-2H-1-BENZOPYRAN-4-YL)-2,3-DIHYDRO-5-METHOXY-, ETHYL ESTER, (2S)-

Preferred Name

English

ETHYL (2S)-1-((2R,3S,4R)-2-(DIMETHOXYMETHYL)-3,4-DIHYDRO-3-HYDROXY-2-METHYL-6-NITRO-2H-1-BENZOPYRAN-4-YL)-2,3-DIHYDRO-5-METHOXY-1H-INDOLE-2-CARBOXYLATE

Systematic Name

English

KR31761

Code

English

Code System Code Type Description

FDA UNII

EWB3SK7WEH

Created by admin on Wed Apr 02 11:26:06 GMT 2025 , Edited by admin on Wed Apr 02 11:26:06 GMT 2025

PRIMARY

PUBCHEM

10185465

Created by admin on Wed Apr 02 11:26:06 GMT 2025 , Edited by admin on Wed Apr 02 11:26:06 GMT 2025

PRIMARY

CAS

412280-60-5

Created by admin on Wed Apr 02 11:26:06 GMT 2025 , Edited by admin on Wed Apr 02 11:26:06 GMT 2025

PRIMARY

Related Record Type Details


					EWB3SK7WEH

KR-31761

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