Solavetivol

C15H24O — CID 50909827

IUPAC(3R,5S,6R,8S)-6,10-dimethyl-3-prop-1-en-2-ylspiro[4.5]dec-9-en-8-ol
SMILESC[C@@H]1C[C@@H](C=C([C@]12CC[C@H](C2)C(=C)C)C)O
InChIInChI=1S/C15H24O/c1-10(2)13-5-6-15(9-13)11(3)7-14(16)8-12(15)4/h7,12-14,16H,1,5-6,8-9H2,2-4H3/t12-,13-,14-,15-/m1/s1
InChIKeyQRPWLSKPROEDAH-KBUPBQIOSA-N
MW220.35 g/mol
LogP4.10
Rot. Bonds1

About Solavetivol

Solavetivol (PubChem CID 50909827) has the molecular formula C15H24O and a molecular weight of 220.35 g/mol. Its IUPAC name is (3R,5S,6R,8S)-6,10-dimethyl-3-prop-1-en-2-ylspiro[4.5]dec-9-en-8-ol.

Molecular Properties

Compound NameSolavetivol
PubChem CID50909827
Molecular FormulaC15H24O
Molecular Weight220.35 g/mol
Exact Mass220.18
IUPAC Name(3R,5S,6R,8S)-6,10-dimethyl-3-prop-1-en-2-ylspiro[4.5]dec-9-en-8-ol
SMILESC[C@@H]1C[C@@H](C=C([C@]12CC[C@H](C2)C(=C)C)C)O
InChIInChI=1S/C15H24O/c1-10(2)13-5-6-15(9-13)11(3)7-14(16)8-12(15)4/h7,12-14,16H,1,5-6,8-9H2,2-4H3/t12-,13-,14-,15-/m1/s1
InChIKeyQRPWLSKPROEDAH-KBUPBQIOSA-N
XLogP4.10
TPSA20.20 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity328

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.35
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of Solavetivol?
The IUPAC name of Solavetivol (CID 50909827) is (3R,5S,6R,8S)-6,10-dimethyl-3-prop-1-en-2-ylspiro[4.5]dec-9-en-8-ol.
What is the SMILES notation for Solavetivol?
The canonical SMILES for Solavetivol is C[C@@H]1C[C@@H](C=C([C@]12CC[C@H](C2)C(=C)C)C)O.
What is the InChIKey of Solavetivol?
The InChIKey is QRPWLSKPROEDAH-KBUPBQIOSA-N. The full InChI is InChI=1S/C15H24O/c1-10(2)13-5-6-15(9-13)11(3)7-14(16)8-12(15)4/h7,12-14,16H,1,5-6,8-9H2,2-4H3/t12-,13-,14-,15-/m1/s1.
What are the key properties of Solavetivol?
Solavetivol has a molecular weight of 220.35 g/mol, XLogP of 4.10, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for Solavetivol is sourced from PubChem (CID 50909827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).