(2R,3S,4R,5S,6S)-2-[[(2R,3R,4S,5R,6R)-6-[[(2R,3R,4S,5R,6S)-6-[(2R,3S,4S,5R,6R)-2-[[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,5-dihydroxy-6-methoxyoxan-4-yl]oxy-3,4-dihydroxy-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol

C43H74O33 — CID 101436561

About (2R,3S,4R,5S,6S)-2-[[(2R,3R,4S,5R,6R)-6-[[(2R,3R,4S,5R,6S)-6-[(2R,3S,4S,5R,6R)-2-[[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,5-dihydroxy-6-methoxyoxan-4-yl]oxy-3,4-dihydroxy-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol

(2R,3S,4R,5S,6S)-2-[[(2R,3R,4S,5R,6R)-6-[[(2R,3R,4S,5R,6S)-6-[(2R,3S,4S,5R,6R)-2-[[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,5-dihydroxy-6-methoxyoxan-4-yl]oxy-3,4-dihydroxy-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol (PubChem CID 101436561) has the molecular formula C43H74O33 and a molecular weight of 1119.03 g/mol. Its IUPAC name is (2R,3S,4R,5S,6S)-2-[[(2R,3R,4S,5R,6R)-6-[[(2R,3R,4S,5R,6S)-6-[(2R,3S,4S,5R,6R)-2-[[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,5-dihydroxy-6-methoxyoxan-4-yl]oxy-3,4-dihydroxy-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol.

Molecular Properties

• Compound Name: (2R,3S,4R,5S,6S)-2-[[(2R,3R,4S,5R,6R)-6-[[(2R,3R,4S,5R,6S)-6-[(2R,3S,4S,5R,6R)-2-[[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,5-dihydroxy-6-methoxyoxan-4-yl]oxy-3,4-dihydroxy-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol
• PubChem CID: 101436561
• Molecular Formula: C43H74O33
• Molecular Weight: 1119.03 g/mol
• Exact Mass: 1118.41
• IUPAC Name: (2R,3S,4R,5S,6S)-2-[[(2R,3R,4S,5R,6R)-6-[[(2R,3R,4S,5R,6S)-6-[(2R,3S,4S,5R,6R)-2-[[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,5-dihydroxy-6-methoxyoxan-4-yl]oxy-3,4-dihydroxy-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol
• SMILES: CO[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO[C@@H]4O[C@@H](C)[C@@H](O)C(O)[C@@H]4O)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)[C@H]1O
• InChI: InChI=1S/C43H74O33/c1-9-16(45)23(52)29(58)38(67-9)64-6-13-20(49)26(55)30(59)39(72-13)65-7-14-21(50)28(57)36(76-41-32(61)25(54)18(47)11(3)69-41)43(73-14)74-34-22(51)15(71-37(63-4)33(34)62)8-66-42-35(27(56)19(48)12(5-44)70-42)75-40-31(60)24(53)17(46)10(2)68-40/h9-62H,5-8H2,1-4H3/t9-,10-,11-,12+,13+,14+,15+,16+,17+,18+,19-,20-,21-,22-,23?,24+,25+,26-,27-,28-,29-,30+,31-,32-,33+,34-,35+,36+,37+,38+,39+,40-,41-,42+,43-/m0/s1
• InChIKey: PWNPLCFCQPWKFK-ASRQDVTMSA-N
• XLogP: -12.54
• TPSA: 513.59 Ų
• H-Bond Donors: 19
• H-Bond Acceptors: 33
• Rotatable Bonds: 17
• Heavy Atoms: 76
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1119.03
LogP ≤ 5	-12.54
H-Bond Donors ≤ 5	19
H-Bond Acceptors ≤ 10	33

Frequently Asked Questions

What is the IUPAC name of (2R,3S,4R,5S,6S)-2-[[(2R,3R,4S,5R,6R)-6-[[(2R,3R,4S,5R,6S)-6-[(2R,3S,4S,5R,6R)-2-[[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,5-dihydroxy-6-methoxyoxan-4-yl]oxy-3,4-dihydroxy-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol?

The IUPAC name of (2R,3S,4R,5S,6S)-2-[[(2R,3R,4S,5R,6R)-6-[[(2R,3R,4S,5R,6S)-6-[(2R,3S,4S,5R,6R)-2-[[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,5-dihydroxy-6-methoxyoxan-4-yl]oxy-3,4-dihydroxy-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol (CID 101436561) is (2R,3S,4R,5S,6S)-2-[[(2R,3R,4S,5R,6R)-6-[[(2R,3R,4S,5R,6S)-6-[(2R,3S,4S,5R,6R)-2-[[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,5-dihydroxy-6-methoxyoxan-4-yl]oxy-3,4-dihydroxy-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol.

What is the SMILES notation for (2R,3S,4R,5S,6S)-2-[[(2R,3R,4S,5R,6R)-6-[[(2R,3R,4S,5R,6S)-6-[(2R,3S,4S,5R,6R)-2-[[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,5-dihydroxy-6-methoxyoxan-4-yl]oxy-3,4-dihydroxy-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol?

The canonical SMILES for (2R,3S,4R,5S,6S)-2-[[(2R,3R,4S,5R,6R)-6-[[(2R,3R,4S,5R,6S)-6-[(2R,3S,4S,5R,6R)-2-[[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,5-dihydroxy-6-methoxyoxan-4-yl]oxy-3,4-dihydroxy-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol is CO[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO[C@@H]4O[C@@H](C)[C@@H](O)C(O)[C@@H]4O)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)[C@H]1O.

What is the InChIKey of (2R,3S,4R,5S,6S)-2-[[(2R,3R,4S,5R,6R)-6-[[(2R,3R,4S,5R,6S)-6-[(2R,3S,4S,5R,6R)-2-[[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,5-dihydroxy-6-methoxyoxan-4-yl]oxy-3,4-dihydroxy-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol?

The InChIKey is PWNPLCFCQPWKFK-ASRQDVTMSA-N. The full InChI is InChI=1S/C43H74O33/c1-9-16(45)23(52)29(58)38(67-9)64-6-13-20(49)26(55)30(59)39(72-13)65-7-14-21(50)28(57)36(76-41-32(61)25(54)18(47)11(3)69-41)43(73-14)74-34-22(51)15(71-37(63-4)33(34)62)8-66-42-35(27(56)19(48)12(5-44)70-42)75-40-31(60)24(53)17(46)10(2)68-40/h9-62H,5-8H2,1-4H3/t9-,10-,11-,12+,13+,14+,15+,16+,17+,18+,19-,20-,21-,22-,23?,24+,25+,26-,27-,28-,29-,30+,31-,32-,33+,34-,35+,36+,37+,38+,39+,40-,41-,42+,43-/m0/s1.

What are the key properties of (2R,3S,4R,5S,6S)-2-[[(2R,3R,4S,5R,6R)-6-[[(2R,3R,4S,5R,6S)-6-[(2R,3S,4S,5R,6R)-2-[[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,5-dihydroxy-6-methoxyoxan-4-yl]oxy-3,4-dihydroxy-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol?

(2R,3S,4R,5S,6S)-2-[[(2R,3R,4S,5R,6R)-6-[[(2R,3R,4S,5R,6S)-6-[(2R,3S,4S,5R,6R)-2-[[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,5-dihydroxy-6-methoxyoxan-4-yl]oxy-3,4-dihydroxy-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol has a molecular weight of 1119.03 g/mol, XLogP of -12.54, 17 rotatable bonds, 19 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for (2R,3S,4R,5S,6S)-2-[[(2R,3R,4S,5R,6R)-6-[[(2R,3R,4S,5R,6S)-6-[(2R,3S,4S,5R,6R)-2-[[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,5-dihydroxy-6-methoxyoxan-4-yl]oxy-3,4-dihydroxy-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol is sourced from PubChem (CID 101436561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).