Pacritinib Metabolite M7

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C28H29N3O9
Molecular Weight	551.5446
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O[C@H]1[C@H](OC2=CC=C3C=C2COC\C=C\COCC4=CC(=CC=C4)C5=CC=NC(N5)=N3)O[C@@H]([C@@H](O)[C@@H]1O)C(O)=O

InChI

InChIKey=IAIXZUWYISFNGD-RYADJKIWSA-N

InChI=1S/C28H29N3O9/c32-22-23(33)25(26(35)36)40-27(24(22)34)39-21-7-6-19-13-18(21)15-38-11-2-1-10-37-14-16-4-3-5-17(12-16)20-8-9-29-28(30-19)31-20/h1-9,12-13,22-25,27,32-34H,10-11,14-15H2,(H,35,36)(H,29,30,31)/b2-1+/t22-,23-,24+,25-,27+/m0/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

Pacritinib Metabolite M7

Common Name

English

(2S,3S,4S,5R,6S)-6-(((2.sup.2E,8E)-2.sup.1,2.sup.2-dihydro-6,11-dioxa-3-aza-2(6,2)-pyrimidina-1,4(1,3)-dibenzenacyclododecaphan-8-en-4.sup.4-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid

Systematic Name

English

Code System Code Type Description

PUBCHEM

166177299

Created by admin on Sat Dec 16 19:30:36 GMT 2023 , Edited by admin on Sat Dec 16 19:30:36 GMT 2023

PRIMARY

FDA UNII

C3TTL945JN

Created by admin on Sat Dec 16 19:30:36 GMT 2023 , Edited by admin on Sat Dec 16 19:30:36 GMT 2023

PRIMARY

PARENT (METABOLITE)