(2R,3S,4R)-2-[(3E)-3-[[(2R,3S,4R)-3-hydroxy-4-[(1E,3E)-penta-1,3-dienyl]oxolan-2-yl]methylidene]pent-4-enyl]-4-[(1E,3E)-penta-1,3-dienyl]oxolan-3-ol

C24H34O4 — CID 24764407

IUPAC(2R,3S,4R)-2-[(3E)-3-[[(2R,3S,4R)-3-hydroxy-4-[(1E,3E)-penta-1,3-dienyl]oxolan-2-yl]methylidene]pent-4-enyl]-4-[(1E,3E)-penta-1,3-dienyl]oxolan-3-ol
SMILESC=C/C(=C/[C@H]1OC[C@@H](/C=C/C=C/C)[C@@H]1O)CC[C@H]1OC[C@@H](/C=C/C=C/C)[C@@H]1O
InChIInChI=1S/C24H34O4/c1-4-7-9-11-19-16-27-21(23(19)25)14-13-18(6-3)15-22-24(26)20(17-28-22)12-10-8-5-2/h4-12,15,19-26H,3,13-14,16-17H2,1-2H3/b7-4+,8-5+,11-9+,12-10+,18-15-/t19-,20-,21-,22-,23+,24+/m1/s1
InChIKeyTVZDVFPOFVVQBJ-FQHJKSMCSA-N
MW386.53 g/mol
LogP3.90
Rot. Bonds9

About (2R,3S,4R)-2-[(3E)-3-[[(2R,3S,4R)-3-hydroxy-4-[(1E,3E)-penta-1,3-dienyl]oxolan-2-yl]methylidene]pent-4-enyl]-4-[(1E,3E)-penta-1,3-dienyl]oxolan-3-ol

(2R,3S,4R)-2-[(3E)-3-[[(2R,3S,4R)-3-hydroxy-4-[(1E,3E)-penta-1,3-dienyl]oxolan-2-yl]methylidene]pent-4-enyl]-4-[(1E,3E)-penta-1,3-dienyl]oxolan-3-ol (PubChem CID 24764407) has the molecular formula C24H34O4 and a molecular weight of 386.53 g/mol. Its IUPAC name is (2R,3S,4R)-2-[(3E)-3-[[(2R,3S,4R)-3-hydroxy-4-[(1E,3E)-penta-1,3-dienyl]oxolan-2-yl]methylidene]pent-4-enyl]-4-[(1E,3E)-penta-1,3-dienyl]oxolan-3-ol.

Molecular Properties

Compound Name(2R,3S,4R)-2-[(3E)-3-[[(2R,3S,4R)-3-hydroxy-4-[(1E,3E)-penta-1,3-dienyl]oxolan-2-yl]methylidene]pent-4-enyl]-4-[(1E,3E)-penta-1,3-dienyl]oxolan-3-ol
PubChem CID24764407
Molecular FormulaC24H34O4
Molecular Weight386.53 g/mol
Exact Mass386.25
IUPAC Name(2R,3S,4R)-2-[(3E)-3-[[(2R,3S,4R)-3-hydroxy-4-[(1E,3E)-penta-1,3-dienyl]oxolan-2-yl]methylidene]pent-4-enyl]-4-[(1E,3E)-penta-1,3-dienyl]oxolan-3-ol
SMILESC=C/C(=C/[C@H]1OC[C@@H](/C=C/C=C/C)[C@@H]1O)CC[C@H]1OC[C@@H](/C=C/C=C/C)[C@@H]1O
InChIInChI=1S/C24H34O4/c1-4-7-9-11-19-16-27-21(23(19)25)14-13-18(6-3)15-22-24(26)20(17-28-22)12-10-8-5-2/h4-12,15,19-26H,3,13-14,16-17H2,1-2H3/b7-4+,8-5+,11-9+,12-10+,18-15-/t19-,20-,21-,22-,23+,24+/m1/s1
InChIKeyTVZDVFPOFVVQBJ-FQHJKSMCSA-N
XLogP3.90
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.53
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (2R,3S,4R)-2-[(3E)-3-[[(2R,3S,4R)-3-hydroxy-4-[(1E,3E)-penta-1,3-dienyl]oxolan-2-yl]methylidene]pent-4-enyl]-4-[(1E,3E)-penta-1,3-dienyl]oxolan-3-ol with MolForge

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

Launch Full Analysis

Related Compounds

(1S,2R,4S,7R,8R,10Z,12R)-1,7,11-trimethyl-4-propan-2-yl-15,16-dioxatricyclo[10.2.1.14,7]hexadec-10-ene-2,8-diol
CID 122196277
Restrictinol
CID 10107729
Desmethylrestrictinol
CID 163007352
Amphidinin A
CID 122218512
(2Z,6Z)-3,7,12-trimethyl-14-propan-2-yl-15-oxabicyclo[10.2.1]pentadeca-2,6-dien-13-ol
CID 90677399
Ro09-1544
CID 139587978
Ro09-1547
CID 139588114
(2R,3S,4R,5R)-2-[(2E,4E,6E)-deca-2,4,6-trien-2-yl]-4-methoxy-5-methyloxan-3-ol
CID 134983612
[(6E)-6-methyl-10-methylidene-3-[(1E)-4-methylpenta-1,3-dienyl]-3a,4,5,8,9,10a-hexahydro-1H-cyclonona[c]furan-3-yl]methanol
CID 122397209
1-Nonylphenoxy-2,3-propandiol
CID 129888908
(1S,2R,4S,7R,8S,10Z,12R)-1,7,11-trimethyl-4-propan-2-yl-15,16-dioxatricyclo[10.2.1.14,7]hexadec-10-ene-2,8-diol
CID 166447753
CID 163110882
CID 163110882

Frequently Asked Questions

What is the IUPAC name of (2R,3S,4R)-2-[(3E)-3-[[(2R,3S,4R)-3-hydroxy-4-[(1E,3E)-penta-1,3-dienyl]oxolan-2-yl]methylidene]pent-4-enyl]-4-[(1E,3E)-penta-1,3-dienyl]oxolan-3-ol?
The IUPAC name of (2R,3S,4R)-2-[(3E)-3-[[(2R,3S,4R)-3-hydroxy-4-[(1E,3E)-penta-1,3-dienyl]oxolan-2-yl]methylidene]pent-4-enyl]-4-[(1E,3E)-penta-1,3-dienyl]oxolan-3-ol (CID 24764407) is (2R,3S,4R)-2-[(3E)-3-[[(2R,3S,4R)-3-hydroxy-4-[(1E,3E)-penta-1,3-dienyl]oxolan-2-yl]methylidene]pent-4-enyl]-4-[(1E,3E)-penta-1,3-dienyl]oxolan-3-ol.
What is the SMILES notation for (2R,3S,4R)-2-[(3E)-3-[[(2R,3S,4R)-3-hydroxy-4-[(1E,3E)-penta-1,3-dienyl]oxolan-2-yl]methylidene]pent-4-enyl]-4-[(1E,3E)-penta-1,3-dienyl]oxolan-3-ol?
The canonical SMILES for (2R,3S,4R)-2-[(3E)-3-[[(2R,3S,4R)-3-hydroxy-4-[(1E,3E)-penta-1,3-dienyl]oxolan-2-yl]methylidene]pent-4-enyl]-4-[(1E,3E)-penta-1,3-dienyl]oxolan-3-ol is C=C/C(=C/[C@H]1OC[C@@H](/C=C/C=C/C)[C@@H]1O)CC[C@H]1OC[C@@H](/C=C/C=C/C)[C@@H]1O.
What is the InChIKey of (2R,3S,4R)-2-[(3E)-3-[[(2R,3S,4R)-3-hydroxy-4-[(1E,3E)-penta-1,3-dienyl]oxolan-2-yl]methylidene]pent-4-enyl]-4-[(1E,3E)-penta-1,3-dienyl]oxolan-3-ol?
The InChIKey is TVZDVFPOFVVQBJ-FQHJKSMCSA-N. The full InChI is InChI=1S/C24H34O4/c1-4-7-9-11-19-16-27-21(23(19)25)14-13-18(6-3)15-22-24(26)20(17-28-22)12-10-8-5-2/h4-12,15,19-26H,3,13-14,16-17H2,1-2H3/b7-4+,8-5+,11-9+,12-10+,18-15-/t19-,20-,21-,22-,23+,24+/m1/s1.
What are the key properties of (2R,3S,4R)-2-[(3E)-3-[[(2R,3S,4R)-3-hydroxy-4-[(1E,3E)-penta-1,3-dienyl]oxolan-2-yl]methylidene]pent-4-enyl]-4-[(1E,3E)-penta-1,3-dienyl]oxolan-3-ol?
(2R,3S,4R)-2-[(3E)-3-[[(2R,3S,4R)-3-hydroxy-4-[(1E,3E)-penta-1,3-dienyl]oxolan-2-yl]methylidene]pent-4-enyl]-4-[(1E,3E)-penta-1,3-dienyl]oxolan-3-ol has a molecular weight of 386.53 g/mol, XLogP of 3.90, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S,4R)-2-[(3E)-3-[[(2R,3S,4R)-3-hydroxy-4-[(1E,3E)-penta-1,3-dienyl]oxolan-2-yl]methylidene]pent-4-enyl]-4-[(1E,3E)-penta-1,3-dienyl]oxolan-3-ol is sourced from PubChem (CID 24764407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).