4TD

(2S)-1-[3-[(2S)-2-oxidanylpropoxy]-2-[[(2S)-2-oxidanylpropoxy]methyl]-2-[[(2R)-2-oxidanylpropoxy]methyl]propoxy]propan-2-ol

Created:	2014-01-08
Last modified:	2021-03-01

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2 entries where 4TD is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	61
Chiral Atom Count	4
Bond Count	60
Aromatic Bond Count	0

2D diagram of 4TD

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Chemical Component Summary
Name	(2S)-1-[3-[(2S)-2-oxidanylpropoxy]-2-[[(2S)-2-oxidanylpropoxy]methyl]-2-[[(2R)-2-oxidanylpropoxy]methyl]propoxy]propan-2-ol
Synonyms	tetraerythritol propoxylate
Systematic Name (OpenEye OEToolkits)	(2S)-1-[3-[(2S)-2-oxidanylpropoxy]-2-[[(2S)-2-oxidanylpropoxy]methyl]-2-[[(2R)-2-oxidanylpropoxy]methyl]propoxy]propan-2-ol
Formula	C₁₇ H₃₆ O₈
Molecular Weight	368.463
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O(CC(O)C)CC(COCC(O)C)(COCC(O)C)COCC(O)C
SMILES	CACTVS	3.385	C[CH](O)COC[C](COC[CH](C)O)(COC[CH](C)O)COC[CH](C)O
SMILES	OpenEye OEToolkits	1.7.6	CC(COCC(COCC(C)O)(COCC(C)O)COCC(C)O)O
Canonical SMILES	CACTVS	3.385	C[C@H](O)COC[C@](COC[C@H](C)O)(COC[C@H](C)O)COC[C@@H](C)O
Canonical SMILES	OpenEye OEToolkits	1.7.6	C[C@H](COCC(COC[C@H](C)O)(COC[C@H](C)O)COC[C@H](C)O)O
InChI	InChI	1.03	InChI=1S/C17H36O8/c1-13(18)5-22-9-17(10-23-6-14(2)19,11-24-7-15(3)20)12-25-8-16(4)21/h13-16,18-21H,5-12H2,1-4H3/t13-,14-,15-,16+/m0/s1
InChIKey	InChI	1.03	GXEZGLLPFFKHGE-YHUYYLMFSA-N

Related Resource References

Resource Name	Reference
PubChem	73437617

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