CID 11024581

C18H24O7 — CID 11024581

IUPAC—
SMILESCOC(=O)C1=CC(=O)[C@H]2O[C@@]3(CCCCO3)[C@]3(CCCCO3)O[C@@H]2C1
InChIInChI=1S/C18H24O7/c1-21-16(20)12-10-13(19)15-14(11-12)24-17(6-2-4-8-22-17)18(25-15)7-3-5-9-23-18/h10,14-15H,2-9,11H2,1H3/t14-,15-,17+,18+/m1/s1
InChIKeyWMGJGKVKDZDTKU-LMSBXDPUSA-N
MW352.38 g/mol
LogP1.64
Rot. Bonds1

About CID 11024581

CID 11024581 (PubChem CID 11024581) has the molecular formula C18H24O7 and a molecular weight of 352.38 g/mol.

Molecular Properties

Compound NameCID 11024581
PubChem CID11024581
Molecular FormulaC18H24O7
Molecular Weight352.38 g/mol
Exact Mass352.15
IUPAC Name—
SMILESCOC(=O)C1=CC(=O)[C@H]2O[C@@]3(CCCCO3)[C@]3(CCCCO3)O[C@@H]2C1
InChIInChI=1S/C18H24O7/c1-21-16(20)12-10-13(19)15-14(11-12)24-17(6-2-4-8-22-17)18(25-15)7-3-5-9-23-18/h10,14-15H,2-9,11H2,1H3/t14-,15-,17+,18+/m1/s1
InChIKeyWMGJGKVKDZDTKU-LMSBXDPUSA-N
XLogP1.64
TPSA80.29 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.38
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of CID 11024581?
The IUPAC name of CID 11024581 (CID 11024581) is not available.
What is the SMILES notation for CID 11024581?
The canonical SMILES for CID 11024581 is COC(=O)C1=CC(=O)[C@H]2O[C@@]3(CCCCO3)[C@]3(CCCCO3)O[C@@H]2C1.
What is the InChIKey of CID 11024581?
The InChIKey is WMGJGKVKDZDTKU-LMSBXDPUSA-N. The full InChI is InChI=1S/C18H24O7/c1-21-16(20)12-10-13(19)15-14(11-12)24-17(6-2-4-8-22-17)18(25-15)7-3-5-9-23-18/h10,14-15H,2-9,11H2,1H3/t14-,15-,17+,18+/m1/s1.
What are the key properties of CID 11024581?
CID 11024581 has a molecular weight of 352.38 g/mol, XLogP of 1.64, 1 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for CID 11024581 is sourced from PubChem (CID 11024581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).