(1S,2S,4R,7S)-4-amino-7-benzyl-2-hydroxy-4-methyl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecane-5,8-dione

CAS: 301844-50-8

Molecular Formula	`C17H21N3O4`
Molecular Weight	331.4 g/mol
Topological Polar Surface Area	96.1 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	2
Exact Mass	331.1532
Heavy Atoms	24
Complexity	564.0

Chemical Identifiers

CAS Number	301844-50-8
SMILES	`CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)N`
InChIKey	`YHMWLYYXMIFGNR-CLROSIBMSA-N`

📖 Product Overview

(1S,2S,4R,7S)-4-amino-7-benzyl-2-hydroxy-4-methyl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecane-5,8-dione (CAS: 301844-50-8) is a chemical compound with molecular formula C17H21N3O4 and molecular weight 331.4 g/mol. Its IUPAC systematic name is (1S,2S,4R,7S)-4-amino-7-benzyl-2-hydroxy-4-methyl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecane-5,8-dione. Topological Polar Surface Area 96.1 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 5 Rotatable Bonds 2 Exact Mass 331.1532 Heavy Atoms 24 Complexity 564.0 InChI Key: YHMWLYYXMIFGNR-CLROSIBMSA-N. SMILES: CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)N.

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