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biotin sulfone

Properties

Image

Occurences in reactions

MNX_ID

MNXM44335

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₁₀H₁₆N₂O₅S

charge

mass

276.07799

reference

InChIKey

QPFQYMONYBAUCY-ZKWXMUAHSA-N

InChI

InChI=1S/C10H16N2O5S/c13-8(14)4-2-1-3-7-9-6(5-18(7,16)17)11-10(15)12-9/h6-7,9H,1-5H2,(H,13,14)(H2,11,12,15)/t6-,7-,9-/m0/s1

SMILES

O=C(O)CCCC[C@H]1[C@H]2NC(=O)N[C@H]2CS1(=O)=O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:74092 chebi:74092	biotin sulfone 5,5-Dioxide Biotin 5-[(3aS,4S,6aR)-5,5-dioxido-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoic acid [3aS-(3aa,4b,6aa)]-5,5-dioxide-hexahydro-2-oxo-1H-Thieno[3,4-D]imidazole-4-pentanoic acid
seed.compound:cpd31075 seedM:cpd31075 kegg.compound:C20387 keggC:C20387	Biotin sulfone
hmdb:HMDB0004818	Biotin sulfone 5,5-Dioxide biotin 5-((3AS,4S,6ar)-5,5-dioxido-2-oxohexahydro-1H-thieno(3,4-D)imidazol-4-yl)pentanoic acid 5-[(3aS,4S,6aR)-2,5,5-trioxo-hexahydro-1H-5lambda⁶-thieno[3,4-d]imidazolidin-4-yl]pentanoic acid 5-[(3aS,4S,6aR)-2,5,5-trioxo-hexahydro-5lambda⁶-thieno[3,4-d]imidazolidin-4-yl]pentanoic acid Biotin sulphone Bisnorbiotin methyl ketone [3AS-(3aa,4b,6aa)]- 5,5-dioxide-hexahydro-2-oxo-1H-thieno[3,4-D]imidazole-4-pentanoate [3AS-(3aa,4b,6aa)]- 5,5-dioxide-hexahydro-2-oxo-1H-thieno[3,4-D]imidazole-4-pentanoic acid [3AS-(3aa,4b,6aa)]-5,5-dioxide-hexahydro-2-oxo-1H-thieno[3,4-D]imidazole-4-pentanoate [3AS-(3aa,4b,6aa)]-5,5-dioxide-hexahydro-2-oxo-1H-thieno[3,4-D]imidazole-4-pentanoic acid [3AS-(3aa,4b,6aa)]-tetrahydro-4-(3-oxobutyl)-1H-thieno[3,4-D]imidazol-2(3H)-one
hmdb:HMDB04818 keggC:M_C20387 seedM:M_cpd31075	secondary/obsolete/fantasy identifier