S8V

~{N}-[[(3~{S})-oxolan-3-yl]methyl]cyclopropanamine

Created:	2020-03-05
Last modified:	2020-04-22

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1 entries where S8V is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	25
Chiral Atom Count	1
Bond Count	26
Aromatic Bond Count	0

2D diagram of S8V

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Chemical Component Summary
Name	~{N}-[[(3~{S})-oxolan-3-yl]methyl]cyclopropanamine
Systematic Name (OpenEye OEToolkits)	~{N}-[[(3~{S})-oxolan-3-yl]methyl]cyclopropanamine
Formula	C₈ H₁₅ N O
Molecular Weight	141.211
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	C1C[CH](CNC2CC2)CO1
SMILES	OpenEye OEToolkits	2.0.6	C1CC1NCC2CCOC2
Canonical SMILES	CACTVS	3.385	C1C[C@@H](CNC2CC2)CO1
Canonical SMILES	OpenEye OEToolkits	2.0.6	C1COC[C@@H]1CNC2CC2
InChI	InChI	1.03	InChI=1S/C8H15NO/c1-2-8(1)9-5-7-3-4-10-6-7/h7-9H,1-6H2/t7-/m0/s1
InChIKey	InChI	1.03	XTBAPHZUOIOBDQ-ZETCQYMHSA-N

Related Resource References

Resource Name	Reference
PubChem	30427697

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.