(1R,2Z,6S,11S,12S,15S)-2,6,12,16-tetramethyltricyclo[7.5.2.012,15]hexadeca-2,9(16)-dien-11-ol

C20H32O — CID 163190242

IUPAC(1R,2Z,6S,11S,12S,15S)-2,6,12,16-tetramethyltricyclo[7.5.2.012,15]hexadeca-2,9(16)-dien-11-ol
SMILESCC1=C2CC[C@@H](C)CC/C=C(/C)[C@@H]3CC[C@@](C)([C@H]13)[C@@H](O)C2
InChIInChI=1S/C20H32O/c1-13-6-5-7-14(2)17-10-11-20(4)18(21)12-16(9-8-13)15(3)19(17)20/h7,13,17-19,21H,5-6,8-12H2,1-4H3/b14-7-/t13-,17-,18-,19+,20+/m0/s1
InChIKeyGVJGJZOHUQUEBW-FTHMWMOISA-N
MW288.48 g/mol
LogP5.26
Rot. Bonds

About (1R,2Z,6S,11S,12S,15S)-2,6,12,16-tetramethyltricyclo[7.5.2.012,15]hexadeca-2,9(16)-dien-11-ol

(1R,2Z,6S,11S,12S,15S)-2,6,12,16-tetramethyltricyclo[7.5.2.012,15]hexadeca-2,9(16)-dien-11-ol (PubChem CID 163190242) has the molecular formula C20H32O and a molecular weight of 288.48 g/mol. Its IUPAC name is (1R,2Z,6S,11S,12S,15S)-2,6,12,16-tetramethyltricyclo[7.5.2.012,15]hexadeca-2,9(16)-dien-11-ol.

Molecular Properties

Compound Name(1R,2Z,6S,11S,12S,15S)-2,6,12,16-tetramethyltricyclo[7.5.2.012,15]hexadeca-2,9(16)-dien-11-ol
PubChem CID163190242
Molecular FormulaC20H32O
Molecular Weight288.48 g/mol
Exact Mass288.25
IUPAC Name(1R,2Z,6S,11S,12S,15S)-2,6,12,16-tetramethyltricyclo[7.5.2.012,15]hexadeca-2,9(16)-dien-11-ol
SMILESCC1=C2CC[C@@H](C)CC/C=C(/C)[C@@H]3CC[C@@](C)([C@H]13)[C@@H](O)C2
InChIInChI=1S/C20H32O/c1-13-6-5-7-14(2)17-10-11-20(4)18(21)12-16(9-8-13)15(3)19(17)20/h7,13,17-19,21H,5-6,8-12H2,1-4H3/b14-7-/t13-,17-,18-,19+,20+/m0/s1
InChIKeyGVJGJZOHUQUEBW-FTHMWMOISA-N
XLogP5.26
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500288.48
LogP ≤ 55.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (1R,2Z,6S,11S,12S,15S)-2,6,12,16-tetramethyltricyclo[7.5.2.012,15]hexadeca-2,9(16)-dien-11-ol 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 (1R,2Z,6S,11S,12S,15S)-2,6,12,16-tetramethyltricyclo[7.5.2.012,15]hexadeca-2,9(16)-dien-11-ol?
The IUPAC name of (1R,2Z,6S,11S,12S,15S)-2,6,12,16-tetramethyltricyclo[7.5.2.012,15]hexadeca-2,9(16)-dien-11-ol (CID 163190242) is (1R,2Z,6S,11S,12S,15S)-2,6,12,16-tetramethyltricyclo[7.5.2.012,15]hexadeca-2,9(16)-dien-11-ol.
What is the SMILES notation for (1R,2Z,6S,11S,12S,15S)-2,6,12,16-tetramethyltricyclo[7.5.2.012,15]hexadeca-2,9(16)-dien-11-ol?
The canonical SMILES for (1R,2Z,6S,11S,12S,15S)-2,6,12,16-tetramethyltricyclo[7.5.2.012,15]hexadeca-2,9(16)-dien-11-ol is CC1=C2CC[C@@H](C)CC/C=C(/C)[C@@H]3CC[C@@](C)([C@H]13)[C@@H](O)C2.
What is the InChIKey of (1R,2Z,6S,11S,12S,15S)-2,6,12,16-tetramethyltricyclo[7.5.2.012,15]hexadeca-2,9(16)-dien-11-ol?
The InChIKey is GVJGJZOHUQUEBW-FTHMWMOISA-N. The full InChI is InChI=1S/C20H32O/c1-13-6-5-7-14(2)17-10-11-20(4)18(21)12-16(9-8-13)15(3)19(17)20/h7,13,17-19,21H,5-6,8-12H2,1-4H3/b14-7-/t13-,17-,18-,19+,20+/m0/s1.
What are the key properties of (1R,2Z,6S,11S,12S,15S)-2,6,12,16-tetramethyltricyclo[7.5.2.012,15]hexadeca-2,9(16)-dien-11-ol?
(1R,2Z,6S,11S,12S,15S)-2,6,12,16-tetramethyltricyclo[7.5.2.012,15]hexadeca-2,9(16)-dien-11-ol has a molecular weight of 288.48 g/mol, XLogP of 5.26, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2Z,6S,11S,12S,15S)-2,6,12,16-tetramethyltricyclo[7.5.2.012,15]hexadeca-2,9(16)-dien-11-ol is sourced from PubChem (CID 163190242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).