(3S)-tetrahydrofuran-3-yl (1R,2S)-3-[4-((1R)-2-{[(S)-amino(hydroxy)methyl]oxy}-2,3-dihydro-1H-inden-1-yl)-2-benzyl-3-oxopyrrolidin-2-yl]-1-benzyl-2-hydroxypropylcarbamate (CHEBI:39981)

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CHEBI:39981 - (3S)-tetrahydrofuran-3-yl (1R,2S)-3-[4-((1R)-2-{[(S)-amino(hydroxy)methyl]oxy}-2,3-dihydro-1H-inden-1-yl)-2-benzyl-3-oxopyrrolidin-2-yl]-1-benzyl-2-hydroxypropylcarbamate

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ChEBI ID	CHEBI:39981
ChEBI Name	(3S)-tetrahydrofuran-3-yl (1R,2S)-3-[4-((1R)-2-{[(S)-amino(hydroxy)methyl]oxy}-2,3-dihydro-1H-inden-1-yl)-2-benzyl-3-oxopyrrolidin-2-yl]-1-benzyl-2-hydroxypropylcarbamate
Stars
ASCII Name	(3S)-tetrahydrofuran-3-yl (1R,2S)-3-[4-((1R)-2-{[(S)-amino(hydroxy)methyl]oxy}-2,3-dihydro-1H-inden-1-yl)-2-benzyl-3-oxopyrrolidin-2-yl]-1-benzyl-2-hydroxypropylcarbamate
Last Modified	16 May 2008
Downloads	Molfile

Formula	C36H43N3O7
Net Charge	0
Average Mass	629.754
Monoisotopic Mass	629.31010
SMILES	[H]O[C@@]([H])(O[C@]1([H])C([H])([H])c2c([H])c([H])c([H])c([H])c2[C@]1([H])[C@@]1([H])C(=O)[C@](C([H])([H])c2c([H])c([H])c([H])c([H])c2[H])(C([H])([H])[C@]([H])(O[H])[C@@]([H])(N([H])C(=O)O[C@]2([H])C([H])([H])OC([H])([H])C2([H])[H])C([H])([H])c2c([H])c([H])c([H])c([H])c2[H])N([H])C1([H])[H])N([H])[H]
InChI	InChI=1S/C36H43N3O7/c37-34(42)46-31-18-25-13-7-8-14-27(25)32(31)28-21-38-36(33(28)41,19-24-11-5-2-6-12-24)20-30(40)29(17-23-9-3-1-4-10-23)39-35(43)45-26-15-16-44-22-26/h1-14,26,28-32,34,38,40,42H,15-22,37H2,(H,39,43)/t26-,28-,29-,30-,31+,32+,34-,36-/m0/s1
InChIKey	BYWKHOXUUACYRY-RJAVELRTSA-N

ChEBI Ontology

Outgoing Relation(s)
	(3S)-tetrahydrofuran-3-yl (1R,2S)-3-[4-((1R)-2-{[(S)-amino(hydroxy)methyl]oxy}-2,3-dihydro-1H-inden-1-yl)-2-benzyl-3-oxopyrrolidin-2-yl]-1-benzyl-2-hydroxypropylcarbamate (CHEBI:39981) has parent hydride 1H-indene (CHEBI:41921)
	(3S)-tetrahydrofuran-3-yl (1R,2S)-3-[4-((1R)-2-{[(S)-amino(hydroxy)methyl]oxy}-2,3-dihydro-1H-inden-1-yl)-2-benzyl-3-oxopyrrolidin-2-yl]-1-benzyl-2-hydroxypropylcarbamate (CHEBI:39981) is a carbamate ester (CHEBI:23003)
	(3S)-tetrahydrofuran-3-yl (1R,2S)-3-[4-((1R)-2-{[(S)-amino(hydroxy)methyl]oxy}-2,3-dihydro-1H-inden-1-yl)-2-benzyl-3-oxopyrrolidin-2-yl]-1-benzyl-2-hydroxypropylcarbamate (CHEBI:39981) is a pyrrolidinone (CHEBI:38275)
	(3S)-tetrahydrofuran-3-yl (1R,2S)-3-[4-((1R)-2-{[(S)-amino(hydroxy)methyl]oxy}-2,3-dihydro-1H-inden-1-yl)-2-benzyl-3-oxopyrrolidin-2-yl]-1-benzyl-2-hydroxypropylcarbamate (CHEBI:39981) is a tetrahydrofuryl ester (CHEBI:47020)

Synonyms	Source
(3S)-TETRAHYDROFURAN-3-YL (1R,2S)-3-[4-((1R)-2-{[(S)-AMINO(HYDROXY)METHYL]OXY}-2,3-DIHYDRO-1H-INDEN-1-YL)-2-BENZYL-3-OXOPYRROLIDIN-2-YL]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE	PDBeChem
(3S)-tetrahydrofuran-3-yl {(1S,2S)-3-[(2S,4R)-4-{(1S,2R)-2-[(S)-amino(hydroxy)methoxy]-2,3-dihydro-1H-inden-1-yl}-2-benzyl-3-oxopyrrolidin-2-yl]-1-benzyl-2-hydroxypropyl}carbamate	PDBeChem

Manual Xrefs	Databases
3NH	PDBeChem