(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-propan-2-yloxyoxan-3-yl]oxy-5-[[(2S,4R,5R,6R)-6-ethyl-4,5-dihydroxy-3,4,5,6-tetrahydro-2H-pyran-3-id-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4-diol;rhenium

C22H39O14Re- — CID 173477006

About (2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-propan-2-yloxyoxan-3-yl]oxy-5-[[(2S,4R,5R,6R)-6-ethyl-4,5-dihydroxy-3,4,5,6-tetrahydro-2H-pyran-3-id-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4-diol;rhenium

(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-propan-2-yloxyoxan-3-yl]oxy-5-[[(2S,4R,5R,6R)-6-ethyl-4,5-dihydroxy-3,4,5,6-tetrahydro-2H-pyran-3-id-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4-diol;rhenium (PubChem CID 173477006) has the molecular formula C22H39O14Re- and a molecular weight of 713.75 g/mol. Its IUPAC name is (2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-propan-2-yloxyoxan-3-yl]oxy-5-[[(2S,4R,5R,6R)-6-ethyl-4,5-dihydroxy-3,4,5,6-tetrahydro-2H-pyran-3-id-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4-diol;rhenium.

Molecular Properties

• Compound Name: (2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-propan-2-yloxyoxan-3-yl]oxy-5-[[(2S,4R,5R,6R)-6-ethyl-4,5-dihydroxy-3,4,5,6-tetrahydro-2H-pyran-3-id-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4-diol;rhenium
• PubChem CID: 173477006
• Molecular Formula: C22H39O14Re-
• Molecular Weight: 713.75 g/mol
• Exact Mass: 714.19
• IUPAC Name: (2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-propan-2-yloxyoxan-3-yl]oxy-5-[[(2S,4R,5R,6R)-6-ethyl-4,5-dihydroxy-3,4,5,6-tetrahydro-2H-pyran-3-id-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4-diol;rhenium
• SMILES: CC[C@H]1O[C@@H](O[C@H]2C(O)[C@@H](O)[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](OC(C)C)O[C@@H]3CO)O[C@@H]2CO)[CH-][C@@H](O)[C@H]1O.[Re]
• InChI: InChI=1S/C22H39O14.Re/c1-4-10-14(26)9(25)5-13(32-10)35-19-11(6-23)34-22(18(30)15(19)27)36-20-12(7-24)33-21(31-8(2)3)17(29)16(20)28;/h5,8-30H,4,6-7H2,1-3H3;/q-1;/t9-,10-,11-,12-,13+,14-,15?,16-,17-,18-,19-,20-,21-,22+;/m1./s1
• InChIKey: OAYHOWHHSYPKSB-FDDBWTJSSA-N
• XLogP: -3.88
• TPSA: 217.22 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 14
• Rotatable Bonds: 9
• Heavy Atoms: 37
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	713.75
LogP ≤ 5	-3.88
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	14

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-propan-2-yloxyoxan-3-yl]oxy-5-[[(2S,4R,5R,6R)-6-ethyl-4,5-dihydroxy-3,4,5,6-tetrahydro-2H-pyran-3-id-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4-diol;rhenium?

The IUPAC name of (2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-propan-2-yloxyoxan-3-yl]oxy-5-[[(2S,4R,5R,6R)-6-ethyl-4,5-dihydroxy-3,4,5,6-tetrahydro-2H-pyran-3-id-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4-diol;rhenium (CID 173477006) is (2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-propan-2-yloxyoxan-3-yl]oxy-5-[[(2S,4R,5R,6R)-6-ethyl-4,5-dihydroxy-3,4,5,6-tetrahydro-2H-pyran-3-id-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4-diol;rhenium.

What is the SMILES notation for (2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-propan-2-yloxyoxan-3-yl]oxy-5-[[(2S,4R,5R,6R)-6-ethyl-4,5-dihydroxy-3,4,5,6-tetrahydro-2H-pyran-3-id-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4-diol;rhenium?

The canonical SMILES for (2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-propan-2-yloxyoxan-3-yl]oxy-5-[[(2S,4R,5R,6R)-6-ethyl-4,5-dihydroxy-3,4,5,6-tetrahydro-2H-pyran-3-id-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4-diol;rhenium is CC[C@H]1O[C@@H](O[C@H]2C(O)[C@@H](O)[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](OC(C)C)O[C@@H]3CO)O[C@@H]2CO)[CH-][C@@H](O)[C@H]1O.[Re].

What is the InChIKey of (2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-propan-2-yloxyoxan-3-yl]oxy-5-[[(2S,4R,5R,6R)-6-ethyl-4,5-dihydroxy-3,4,5,6-tetrahydro-2H-pyran-3-id-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4-diol;rhenium?

The InChIKey is OAYHOWHHSYPKSB-FDDBWTJSSA-N. The full InChI is InChI=1S/C22H39O14.Re/c1-4-10-14(26)9(25)5-13(32-10)35-19-11(6-23)34-22(18(30)15(19)27)36-20-12(7-24)33-21(31-8(2)3)17(29)16(20)28;/h5,8-30H,4,6-7H2,1-3H3;/q-1;/t9-,10-,11-,12-,13+,14-,15?,16-,17-,18-,19-,20-,21-,22+;/m1./s1.

What are the key properties of (2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-propan-2-yloxyoxan-3-yl]oxy-5-[[(2S,4R,5R,6R)-6-ethyl-4,5-dihydroxy-3,4,5,6-tetrahydro-2H-pyran-3-id-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4-diol;rhenium?

(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-propan-2-yloxyoxan-3-yl]oxy-5-[[(2S,4R,5R,6R)-6-ethyl-4,5-dihydroxy-3,4,5,6-tetrahydro-2H-pyran-3-id-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4-diol;rhenium has a molecular weight of 713.75 g/mol, XLogP of -3.88, 9 rotatable bonds, 8 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for (2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-propan-2-yloxyoxan-3-yl]oxy-5-[[(2S,4R,5R,6R)-6-ethyl-4,5-dihydroxy-3,4,5,6-tetrahydro-2H-pyran-3-id-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4-diol;rhenium is sourced from PubChem (CID 173477006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).