4-HYDROXYOCHRATOXIN B, (4R)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H19NO7
Molecular Weight	385.3674
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-HYDROXYOCHRATOXIN B, (4R)-

Structure Search

SMILES

C[C@H]1OC(=O)C2=C(O)C(=CC=C2[C@H]1O)C(=O)N[C@@H](CC3=CC=CC=C3)C(O)=O

InChI

InChIKey=XIUVRFQULCIDMO-OOVXXXAESA-N

InChI=1S/C20H19NO7/c1-10-16(22)12-7-8-13(17(23)15(12)20(27)28-10)18(24)21-14(19(25)26)9-11-5-3-2-4-6-11/h2-8,10,14,16,22-23H,9H2,1H3,(H,21,24)(H,25,26)/t10-,14+,16+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C20H19NO7
Molecular Weight	385.3674
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 `Tue Apr 01 17:41:23 GMT 2025` Edited by `admin` on `Tue Apr 01 17:41:23 GMT 2025`
Record UNII	F5Z90MG1NI
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(4R)-4-HYDROXYOCHRATOXIN B

Preferred Name

English

4-HYDROXYOCHRATOXIN B, (4R)-

Common Name

English

4-HYDROXYOCHRATOXIN B

Common Name

English

L-PHENYLALANINE, N-((3,4-DIHYDRO-4,8-DIHYDROXY-3-METHYL-1-OXO-1H-2-BENZOPYRAN-7-YL)CARBONYL)-, (3R-CIS)-

Systematic Name

English

L-PHENYLALANINE, N-(((3R,4R)-3,4-DIHYDRO-4,8-DIHYDROXY-3-METHYL-1-OXO-1H-2-BENZOPYRAN-7-YL)CARBONYL)-

Systematic Name

English

Code System Code Type Description

CAS

97906-06-4

Created by admin on Tue Apr 01 17:41:23 GMT 2025 , Edited by admin on Tue Apr 01 17:41:23 GMT 2025

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FDA UNII

F5Z90MG1NI

Created by admin on Tue Apr 01 17:41:23 GMT 2025 , Edited by admin on Tue Apr 01 17:41:23 GMT 2025

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PUBCHEM

122706751

Created by admin on Tue Apr 01 17:41:23 GMT 2025 , Edited by admin on Tue Apr 01 17:41:23 GMT 2025

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