GG6

[(1S,2S)-1,2-DIHYDROXYPROPYL]PHOSPHONIC ACID

Created:	2007-03-21
Last modified:	2024-09-27

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Chemical Details
Formal Charge	0
Atom Count	18
Chiral Atom Count	0
Bond Count	17
Aromatic Bond Count	0

2D diagram of GG6

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Chemical Component Summary
Name	[(1S,2S)-1,2-DIHYDROXYPROPYL]PHOSPHONIC ACID
Systematic Name (OpenEye OEToolkits)	[(1S,2S)-1,2-dihydroxypropyl]phosphonic acid
Formula	C₃ H₉ O₅ P
Molecular Weight	156.074
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=P(O)(O)C(O)C(O)C
SMILES	CACTVS	3.341	C[CH](O)[CH](O)[P](O)(O)=O
SMILES	OpenEye OEToolkits	1.5.0	CC(C(O)P(=O)(O)O)O
Canonical SMILES	CACTVS	3.341	C[C@H](O)[C@@H](O)[P](O)(O)=O
Canonical SMILES	OpenEye OEToolkits	1.5.0	C[C@@H]([C@@H](O)P(=O)(O)O)O
InChI	InChI	1.03	InChI=1S/C3H9O5P/c1-2(4)3(5)9(6,7)8/h2-5H,1H3,(H2,6,7,8)/t2-,3-/m0/s1
InChIKey	InChI	1.03	MXMXXUIOCREOTJ-HRFVKAFMSA-N

Related Resource References

Resource Name	Reference
PubChem	16220132
ChEBI	CHEBI:85924

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