(3AR,7AS)-5-(BENZYLOXYCARBONYL)-2-(TERT-BUTOXYCARBONYL)OCTAHYDRO-1H-PYRROLO[3,4-C]PYRIDINE-7A-CARBOXYLIC ACID
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![(3AR,7AS)-5-(BENZYLOXYCARBONYL)-2-(TERT-BUTOXYCARBONYL)OCTAHYDRO-1H-PYRROLO[3,4-C]PYRIDINE-7A-CARBOXYLIC ACID structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/03ad0a5f86cd4a9a8338bb0315891b6f.png "(3AR,7AS)-5-(BENZYLOXYCARBONYL)-2-(TERT-BUTOXYCARBONYL)OCTAHYDRO-1H-PYRROLO[3,4-C]PYRIDINE-7A-CARBOXYLIC ACID")
(3AR,7AS)-5-(BENZYLOXYCARBONYL)-2-(TERT-BUTOXYCARBONYL)OCTAHYDRO-1H-PYRROLO[3,4-C]PYRIDINE-7A-CARBOXYLIC ACID
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CAS No:
1217630-99-3
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Formula:
C21H28N2O6
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Chemical Name:
(3AR,7AS)-5-(BENZYLOXYCARBONYL)-2-(TERT-BUTOXYCARBONYL)OCTAHYDRO-1H-PYRROLO[3,4-C]PYRIDINE-7A-CARBOXYLIC ACID
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Synonyms:
(3aR,7aS)-5-((Benzyloxy)carbonyl)-2-(tert-butoxycarbonyl)octahydro-1H-pyrrolo[3,4-c]pyridine-7a-carboxylic acid;(3AR,7AS)-5-(BENZYLOXYCARBONYL)-2-(TERT-BUTOXYCARBONYL)OCTAHYDRO-1H-PYRROLO[3,4-C]PYRIDINE-7A-CARBOXYLIC ACID;1260594-17-9;DTXSID00745363;3999AA;ZINC40443103;MB12283;AM804691;CS-0037429;5-Cbz-2-Boc-3a-H-octahydro-pyrrolo[3,4-c]pyridine-7a-carboxylicacid
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CAS No:
(3AR,7AS)-5-(BENZYLOXYCARBONYL)-2-(TERT-BUTOXYCARBONYL)OCTAHYDRO-1H-PYRROLO[3,4-C]PYRIDINE-7A-CARBOXYLIC ACID Basic Attributes
404.45682
404.19500
DTXSID00745363
Computed Properties
Molecular Weight:404.5
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:404.19473662
Monoisotopic Mass:404.19473662
Topological Polar Surface Area:96.4
Heavy Atom Count:29
Complexity:640
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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(3AR,7AS)-5-(BENZYLOXYCARBONYL)-2-(TERT-BUTOXYCARBONYL)OCTAHYDRO-1H-PYRROLO[3,4-C]PYRIDINE-7A-CARBOXYLIC ACID
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