Ethyl 5-[3-(2-ethoxycarbonyl-2-hydroxy-4-oxo-chroman-5-yl)oxy-2-hydroxy-propoxy]-2-hydroxy-4-oxo-chromane-2-carboxylate

Details

Stereochemistry	ACHIRAL
Molecular Formula	C27H28O13
Molecular Weight	560.5034
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Ethyl 5-[3-(2-ethoxycarbonyl-2-hydroxy-4-oxo-chroman-5-yl)oxy-2-hydroxy-propoxy]-2-hydroxy-4-oxo-chromane-2-carboxylate

Structure Search

SMILES

CCOC(=O)C1(O)CC(=O)C2=C(OCC(O)COC3=CC=CC4=C3C(=O)CC(O)(O4)C(=O)OCC)C=CC=C2O1

InChI

InChIKey=RMLPHRCWKPQXIO-UHFFFAOYSA-N

InChI=1S/C27H28O13/c1-3-35-24(31)26(33)11-16(29)22-18(7-5-9-20(22)39-26)37-13-15(28)14-38-19-8-6-10-21-23(19)17(30)12-27(34,40-21)25(32)36-4-2/h5-10,15,28,33-34H,3-4,11-14H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C27H28O13
Molecular Weight	560.5034
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 17:18:36 GMT 2025` Edited by `admin` on `Wed Apr 02 17:18:36 GMT 2025`
Record UNII	ZWQ47Y3RL9
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2H-1-Benzopyran-2-carboxylic acid, 5,5?-[(2-hydroxy-1,3-propanediyl)bis(oxy)]bis[3,4-dihydro-2-hydroxy-4-oxo-, diethyl ester

Preferred Name

English

Ethyl 5-[3-(2-ethoxycarbonyl-2-hydroxy-4-oxo-chroman-5-yl)oxy-2-hydroxy-propoxy]-2-hydroxy-4-oxo-chromane-2-carboxylate

Systematic Name

English

Code System Code Type Description

FDA UNII

ZWQ47Y3RL9

Created by admin on Wed Apr 02 17:18:36 GMT 2025 , Edited by admin on Wed Apr 02 17:18:36 GMT 2025

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CAS

65518-27-6

Created by admin on Wed Apr 02 17:18:36 GMT 2025 , Edited by admin on Wed Apr 02 17:18:36 GMT 2025

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