Compound C27H37NO5S

2-hydroxy-2-oxoacetate;2-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propyl]sulfanylethyl]piperidin-1-ium

CAS: 15272-28-3

Molecular Formula	`C27H37NO5S`
Molecular Weight	487.7 g/mol
Topological Polar Surface Area	129.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	9
Exact Mass	487.23926
Heavy Atoms	34
Complexity	522.0

Chemical Identifiers

CAS Number	15272-28-3
SMILES	`C1CC[NH2+]C(C1)CCSCC(CC2CCCO2)CC3=CC=CC4=CC=CC=C43.C(=O)(C(=O)[O-])O`
InChIKey	`PCMQZBHZZIADHZ-UHFFFAOYSA-N`

📖 Product Overview

Compound C27H37NO5S (CAS: 15272-28-3) is a chemical compound with molecular formula C27H37NO5S and molecular weight 487.7 g/mol. Its IUPAC systematic name is 2-hydroxy-2-oxoacetate;2-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propyl]sulfanylethyl]piperidin-1-ium. Topological Polar Surface Area 129.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 6 Rotatable Bonds 9 Exact Mass 487.23926 Heavy Atoms 34 Complexity 522.0 InChI Key: PCMQZBHZZIADHZ-UHFFFAOYSA-N. SMILES: C1CC[NH2+]C(C1)CCSCC(CC2CCCO2)CC3=CC=CC4=CC=CC=C43.C(=O)(C(=O)[O-])O.

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