CID 102192763

C23H38O6 — CID 102192763

IUPAC—
SMILESCO[C@@H]1CC2(CCC3(CCCC4C(C)(C)C(OC(C)=O)CCC43C)O2)[C@@H](OC)O1
InChIInChI=1S/C23H38O6/c1-15(24)27-17-9-11-21(4)16(20(17,2)3)8-7-10-23(21)13-12-22(29-23)14-18(25-5)28-19(22)26-6/h16-19H,7-14H2,1-6H3/t16?,17?,18-,19-,21?,22?,23?/m0/s1
InChIKeyHUSWIFOINKVFAU-WHSOSHKASA-N
MW410.55 g/mol
LogP4.20
Rot. Bonds3

About CID 102192763

CID 102192763 (PubChem CID 102192763) has the molecular formula C23H38O6 and a molecular weight of 410.55 g/mol.

Molecular Properties

Compound NameCID 102192763
PubChem CID102192763
Molecular FormulaC23H38O6
Molecular Weight410.55 g/mol
Exact Mass410.27
IUPAC Name—
SMILESCO[C@@H]1CC2(CCC3(CCCC4C(C)(C)C(OC(C)=O)CCC43C)O2)[C@@H](OC)O1
InChIInChI=1S/C23H38O6/c1-15(24)27-17-9-11-21(4)16(20(17,2)3)8-7-10-23(21)13-12-22(29-23)14-18(25-5)28-19(22)26-6/h16-19H,7-14H2,1-6H3/t16?,17?,18-,19-,21?,22?,23?/m0/s1
InChIKeyHUSWIFOINKVFAU-WHSOSHKASA-N
XLogP4.20
TPSA63.22 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.55
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of CID 102192763?
The IUPAC name of CID 102192763 (CID 102192763) is not available.
What is the SMILES notation for CID 102192763?
The canonical SMILES for CID 102192763 is CO[C@@H]1CC2(CCC3(CCCC4C(C)(C)C(OC(C)=O)CCC43C)O2)[C@@H](OC)O1.
What is the InChIKey of CID 102192763?
The InChIKey is HUSWIFOINKVFAU-WHSOSHKASA-N. The full InChI is InChI=1S/C23H38O6/c1-15(24)27-17-9-11-21(4)16(20(17,2)3)8-7-10-23(21)13-12-22(29-23)14-18(25-5)28-19(22)26-6/h16-19H,7-14H2,1-6H3/t16?,17?,18-,19-,21?,22?,23?/m0/s1.
What are the key properties of CID 102192763?
CID 102192763 has a molecular weight of 410.55 g/mol, XLogP of 4.20, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for CID 102192763 is sourced from PubChem (CID 102192763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).