A1JGJ

Summary

Name:	Polyoxidovanadate complex
Formula:	O36 V15
Formal charge:	0
Formula weight:	1340.101 Da
Component type:	non-polymer
Ambiguous Chemistry Warning:	The chemical description of this component is not well described in this definition. Descriptors and chemical names should be used with caution.

Chemical Descriptors

Type	Program	Version	Descriptor
InChI	InChI	1.06	InChI=1S/36O.15V
InChIKey	InChI	1.06	MLPKQJKZYNCEKM-UHFFFAOYSA-N
SMILES_CANONICAL	CACTVS	3.385	O=[V]1O[V](=O)O[V]2(=O)O[V]3(=O)O[V](=O)(O1)O[V]4(=O)O[V](=O)O[V](=O)(O[V]5(=O)O[V](=O)(O4)O5)O[V]6(=O)O[V](=O)(O3)O[V](=O)(O2)O[V]7(=O)O[V](=O)(O6)O7
SMILES	CACTVS	3.385	O=[V]1O[V](=O)O[V]2(=O)O[V]3(=O)O[V](=O)(O1)O[V]4(=O)O[V](=O)O[V](=O)(O[V]5(=O)O[V](=O)(O4)O5)O[V]6(=O)O[V](=O)(O3)O[V](=O)(O2)O[V]7(=O)O[V](=O)(O6)O7
SMILES_CANONICAL	OpenEye OEToolkits	2.0.7	O=[V]123O[V]45(=O)O6[V]78(=O)O1[V]91(=O)O7[V]7%10(=O)O9[V]9%11(=O)O7[V]7%12(=O)O9[V]9%13(=O)O%11[V]%11(=O)(O12)O3[V]1(=O)(O%119)O4[V]23(=O)O1[V]1(=O)(O%13)O7[V]4(=O)(O12)O%12[V]1(=O)(O%10)O8[V]6(=O)(O53)O14
SMILES	OpenEye OEToolkits	2.0.7	O=[V]123O[V]45(=O)O6[V]78(=O)O1[V]91(=O)O7[V]7%10(=O)O9[V]9%11(=O)O7[V]7%12(=O)O9[V]9%13(=O)O%11[V]%11(=O)(O12)O3[V]1(=O)(O%119)O4[V]23(=O)O1[V]1(=O)(O%13)O7[V]4(=O)(O12)O%12[V]1(=O)(O%10)O8[V]6(=O)(O53)O14