17-HYDROXY PELIGLITAZAR

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C30H30N2O8
Molecular Weight	546.5678
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=CC=C(OC(=O)N(CC(O)=O)[C@@H](C)C2=CC=C(OCCC3=C(C)OC(=N3)C4=CC=C(O)C=C4)C=C2)C=C1

InChI

InChIKey=NNJSFKKJLSXBPJ-IBGZPJMESA-N

InChI=1S/C30H30N2O8/c1-19(32(18-28(34)35)30(36)40-26-14-12-24(37-3)13-15-26)21-6-10-25(11-7-21)38-17-16-27-20(2)39-29(31-27)22-4-8-23(33)9-5-22/h4-15,19,33H,16-18H2,1-3H3,(H,34,35)/t19-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C30H30N2O8
Molecular Weight	546.5678
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:06:31 GMT 2023` Edited by `admin` on `Sat Dec 16 16:06:31 GMT 2023`
Record UNII	NEP4154Y9B
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

17-HYDROXY PELIGLITAZAR

Common Name

English

GLYCINE, N-((1S)-1-(4-(2-(2-(4-HYDROXYPHENYL)-5-METHYL-4-OXAZOLYL)ETHOXY)PHENYL)ETHYL)-N-((4-METHOXYPHENOXY)CARBONYL)-

Systematic Name

English

PELIGLITAZAR METABOLITE M5

Common Name

English

Code System Code Type Description

PUBCHEM

136961849

Created by admin on Sat Dec 16 16:06:31 GMT 2023 , Edited by admin on Sat Dec 16 16:06:31 GMT 2023

PRIMARY

FDA UNII

NEP4154Y9B

Created by admin on Sat Dec 16 16:06:31 GMT 2023 , Edited by admin on Sat Dec 16 16:06:31 GMT 2023

PRIMARY

CAS

1807608-54-3

Created by admin on Sat Dec 16 16:06:31 GMT 2023 , Edited by admin on Sat Dec 16 16:06:31 GMT 2023

PRIMARY

Related Record Type Details


					D26ZN076H1

PELIGLITAZAR

PARENT -> METABOLITE

Comments:

0.88% of dose in group 1 and 0.90% of the dose in group 2

Qualification:

FECAL

Amount:


					D26ZN076H1

PELIGLITAZAR

PARENT -> METABOLITE

Interaction Type:

TRACE

Qualification:

URINE