10-HYDROXYOCHRATOXIN A

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H18ClNO7
Molecular Weight	419.812
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC[C@@H]1CC2=C(Cl)C=C(C(=O)N[C@@H](CC3=CC=CC=C3)C(O)=O)C(O)=C2C(=O)O1

InChI

InChIKey=GHTAWZGQTQGHOQ-NHYWBVRUSA-N

InChI=1S/C20H18ClNO7/c21-14-8-13(17(24)16-12(14)7-11(9-23)29-20(16)28)18(25)22-15(19(26)27)6-10-4-2-1-3-5-10/h1-5,8,11,15,23-24H,6-7,9H2,(H,22,25)(H,26,27)/t11-,15-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C20H18ClNO7
Molecular Weight	419.812
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:51:50 GMT 2023` Edited by `admin` on `Fri Dec 15 17:51:50 GMT 2023`
Record UNII	U3MYZ58586
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

10-HYDROXYOCHRATOXIN A

Common Name

English

L-PHENYLALANINE, N-((5-CHLORO-3,4-DIHYDRO-8-HYDROXY-3-(HYDROXYMETHYL)-1-OXO-1H-2-BENZOPYRAN-7-YL)CARBONYL)-, (S)-

Systematic Name

English

Code System Code Type Description

FDA UNII

U3MYZ58586