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Summary Geometry Related PDB entries

A1HZ2

Summary

Name:	(5~{S})-3-(2,3,4-trimethoxyphenyl)-1-oxa-2,9-diazaspiro[4.5]dec-2-ene-8,10-dione
Formula:	C16 H18 N2 O6
Formal charge:	0
Formula weight:	334.324 Da
Component type:	non-polymer

Chemical Identifiers

Program	Version	Name
OpenEye OEToolkits	2.0.7	(5~{S})-3-(2,3,4-trimethoxyphenyl)-1-oxa-2,9-diazaspiro[4.5]dec-2-ene-8,10-dione

Chemical Descriptors

Type	Program	Version	Descriptor
InChI	InChI	1.06	InChI=1S/C16H18N2O6/c1-21-11-5-4-9(13(22-2)14(11)23-3)10-8-16(24-18-10)7-6-12(19)17-15(16)20/h4-5H,6-8H2,1-3H3,(H,17,19,20)/t16-/m0/s1
InChIKey	InChI	1.06	RKTBPSUWUCWUFM-INIZCTEOSA-N
SMILES_CANONICAL	CACTVS	3.385	COc1ccc(C2=NO[C@@]3(CCC(=O)NC3=O)C2)c(OC)c1OC
SMILES	CACTVS	3.385	COc1ccc(C2=NO[C]3(CCC(=O)NC3=O)C2)c(OC)c1OC
SMILES_CANONICAL	OpenEye OEToolkits	2.0.7	COc1ccc(c(c1OC)OC)C2=NO[C@]3(C2)CCC(=O)NC3=O
SMILES	OpenEye OEToolkits	2.0.7	COc1ccc(c(c1OC)OC)C2=NOC3(C2)CCC(=O)NC3=O

222415

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