CID 155930091

C20H20O4 — CID 155930091

IUPAC—
SMILESO=C1CC[C@]2(CCC3=C2C2=C(C3)CC3=C2[C@]2(CCC(=O)O2)CC3)O1
InChIInChI=1S/C20H20O4/c21-14-3-7-19(23-14)5-1-11-9-13-10-12-2-6-20(8-4-15(22)24-20)18(12)16(13)17(11)19/h1-10H2/t19-,20+
InChIKeyHEULFYATRJCIPM-BGYRXZFFSA-N
MW324.38 g/mol
LogP3.42
Rot. Bonds

About CID 155930091

CID 155930091 (PubChem CID 155930091) has the molecular formula C20H20O4 and a molecular weight of 324.38 g/mol.

Molecular Properties

Compound NameCID 155930091
PubChem CID155930091
Molecular FormulaC20H20O4
Molecular Weight324.38 g/mol
Exact Mass324.14
IUPAC Name—
SMILESO=C1CC[C@]2(CCC3=C2C2=C(C3)CC3=C2[C@]2(CCC(=O)O2)CC3)O1
InChIInChI=1S/C20H20O4/c21-14-3-7-19(23-14)5-1-11-9-13-10-12-2-6-20(8-4-15(22)24-20)18(12)16(13)17(11)19/h1-10H2/t19-,20+
InChIKeyHEULFYATRJCIPM-BGYRXZFFSA-N
XLogP3.42
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of CID 155930091?
The IUPAC name of CID 155930091 (CID 155930091) is not available.
What is the SMILES notation for CID 155930091?
The canonical SMILES for CID 155930091 is O=C1CC[C@]2(CCC3=C2C2=C(C3)CC3=C2[C@]2(CCC(=O)O2)CC3)O1.
What is the InChIKey of CID 155930091?
The InChIKey is HEULFYATRJCIPM-BGYRXZFFSA-N. The full InChI is InChI=1S/C20H20O4/c21-14-3-7-19(23-14)5-1-11-9-13-10-12-2-6-20(8-4-15(22)24-20)18(12)16(13)17(11)19/h1-10H2/t19-,20+.
What are the key properties of CID 155930091?
CID 155930091 has a molecular weight of 324.38 g/mol, XLogP of 3.42, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 155930091 is sourced from PubChem (CID 155930091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).