CID 58213413

C11H19O10 — CID 58213413

IUPAC—
SMILESOC[C@H]1O[C@@](CO)(O[C@H]2O[CH][C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C11H19O10/c12-1-5-7(16)9(18)11(3-13,20-5)21-10-8(17)6(15)4(14)2-19-10/h2,4-10,12-18H,1,3H2/t4-,5-,6+,7-,8-,9+,10-,11+/m1/s1
InChIKeyQQOZOSCTCRNDLO-ZHFBNFJVSA-N
MW311.26 g/mol
LogP-4.59
Rot. Bonds4

About CID 58213413

CID 58213413 (PubChem CID 58213413) has the molecular formula C11H19O10 and a molecular weight of 311.26 g/mol.

Molecular Properties

Compound NameCID 58213413
PubChem CID58213413
Molecular FormulaC11H19O10
Molecular Weight311.26 g/mol
Exact Mass311.10
IUPAC Name—
SMILESOC[C@H]1O[C@@](CO)(O[C@H]2O[CH][C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C11H19O10/c12-1-5-7(16)9(18)11(3-13,20-5)21-10-8(17)6(15)4(14)2-19-10/h2,4-10,12-18H,1,3H2/t4-,5-,6+,7-,8-,9+,10-,11+/m1/s1
InChIKeyQQOZOSCTCRNDLO-ZHFBNFJVSA-N
XLogP-4.59
TPSA169.30 Ų
H-Bond Donors7
H-Bond Acceptors10
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500311.26
LogP ≤ 5-4.59
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1010

Analyze CID 58213413 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S,3S,4S,5R,6S)-6-[3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxyoxane-2,3,4,5-tetrol
CID 163199414
(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
CID 173264286
2-[3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
CID 170923599
(3R,4S,5R,6R)-2-[(2S,3S,4S,5S)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
CID 6326101
(3S,4R,5R,6S)-2-[(3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
CID 156614239
(2R,3S,4S,5S,6S)-2-[(2S,3R,4R,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
CID 94011386
(2R,3S,4R,5S,6R)-4-amino-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,5-diol
CID 10359950
(2R,3R,4S,5S,6R)-2-[(3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;molecular nitrogen
CID 141027968
(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;ethane-1,2-diol
CID 69428885
(E)-3-[(E)-3-aminoprop-2-enoxy]prop-1-en-1-amine;(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
CID 67841046
(2R,4S,5S)-2-[(2S,3R,5S)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-methyloxane-3,4,5-triol
CID 71024599
(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;silicic acid
CID 131713215

Frequently Asked Questions

What is the IUPAC name of CID 58213413?
The IUPAC name of CID 58213413 (CID 58213413) is not available.
What is the SMILES notation for CID 58213413?
The canonical SMILES for CID 58213413 is OC[C@H]1O[C@@](CO)(O[C@H]2O[CH][C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O.
What is the InChIKey of CID 58213413?
The InChIKey is QQOZOSCTCRNDLO-ZHFBNFJVSA-N. The full InChI is InChI=1S/C11H19O10/c12-1-5-7(16)9(18)11(3-13,20-5)21-10-8(17)6(15)4(14)2-19-10/h2,4-10,12-18H,1,3H2/t4-,5-,6+,7-,8-,9+,10-,11+/m1/s1.
What are the key properties of CID 58213413?
CID 58213413 has a molecular weight of 311.26 g/mol, XLogP of -4.59, 4 rotatable bonds, 7 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58213413 is sourced from PubChem (CID 58213413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).