AC1LWUQB structure

AC1LWUQB

(2S,3S)-3-methyl-2-[[2-[(4-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]acetyl]amino]pentanoic acid

Also Known As: (2S,3S)-3-methyl-2-(2-((4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy)acetamido)pentanoic acid|(2S,3S)-3-methyl-2-[[2-[(4-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]acetyl]amino]pentanoic acid

CAS: 956041-07-9
Molecular Formula C22H27NO6
Molecular Weight 401.18384 g/mol
LogP 2.97452
Topological Polar Surface Area 105.84 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 5
Rotatable Bonds 7
Exact Mass 401.18384
Monoisotopic Mass 401.18384
Heavy Atoms 29
Complexity 992.94055

Chemical Identifiers

CAS Number 956041-07-9
SMILES CC[C@H](C)[C@@H](C(=O)O)NC(=O)COC1=C(C2=C(C=C1)C3=C(CCCC3)C(=O)O2)C

Product Overview

AC1LWUQB (CAS 956041-07-9), with molecular formula C22H27NO6 and molecular weight 401.18384 g/mol. IUPAC: (2S,3S)-3-methyl-2-[[2-[(4-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]acetyl]amino]pentanoic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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