CID 11844109

C20H32O5 — CID 11844109

IUPAC—
SMILESC[C@@H]1CC(=O)[C@H]2C(C)(C)[C@@H](O)CC[C@]2(C)[C@@]12CC[C@@]1(CCO[C@H]1O)O2
InChIInChI=1S/C20H32O5/c1-12-11-13(21)15-17(2,3)14(22)5-6-18(15,4)20(12)8-7-19(25-20)9-10-24-16(19)23/h12,14-16,22-23H,5-11H2,1-4H3/t12-,14+,15+,16-,18+,19+,20-/m1/s1
InChIKeyPITIZJDONNHGKA-KXOMVGNFSA-N
MW352.47 g/mol
LogP2.43
Rot. Bonds

About CID 11844109

CID 11844109 (PubChem CID 11844109) has the molecular formula C20H32O5 and a molecular weight of 352.47 g/mol.

Molecular Properties

Compound NameCID 11844109
PubChem CID11844109
Molecular FormulaC20H32O5
Molecular Weight352.47 g/mol
Exact Mass352.22
IUPAC Name—
SMILESC[C@@H]1CC(=O)[C@H]2C(C)(C)[C@@H](O)CC[C@]2(C)[C@@]12CC[C@@]1(CCO[C@H]1O)O2
InChIInChI=1S/C20H32O5/c1-12-11-13(21)15-17(2,3)14(22)5-6-18(15,4)20(12)8-7-19(25-20)9-10-24-16(19)23/h12,14-16,22-23H,5-11H2,1-4H3/t12-,14+,15+,16-,18+,19+,20-/m1/s1
InChIKeyPITIZJDONNHGKA-KXOMVGNFSA-N
XLogP2.43
TPSA75.99 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.47
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze CID 11844109 with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of CID 11844109?
The IUPAC name of CID 11844109 (CID 11844109) is not available.
What is the SMILES notation for CID 11844109?
The canonical SMILES for CID 11844109 is C[C@@H]1CC(=O)[C@H]2C(C)(C)[C@@H](O)CC[C@]2(C)[C@@]12CC[C@@]1(CCO[C@H]1O)O2.
What is the InChIKey of CID 11844109?
The InChIKey is PITIZJDONNHGKA-KXOMVGNFSA-N. The full InChI is InChI=1S/C20H32O5/c1-12-11-13(21)15-17(2,3)14(22)5-6-18(15,4)20(12)8-7-19(25-20)9-10-24-16(19)23/h12,14-16,22-23H,5-11H2,1-4H3/t12-,14+,15+,16-,18+,19+,20-/m1/s1.
What are the key properties of CID 11844109?
CID 11844109 has a molecular weight of 352.47 g/mol, XLogP of 2.43, 0 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for CID 11844109 is sourced from PubChem (CID 11844109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).