Molecule record

(1S,2S,4R,8S,9S,11S,12S,13R)-11-hydroxy-8-(2-hydroxyacetyl)-9,13-dimethyl-6-propyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-16-one

C25H34O6

430.54 g/mol

Loading structure

Molecular properties

Formula
C25H34O6
Molar mass
430.54 g·mol−1
Exact mass
430.2355 Da
9
PubChem CID
5281004

Functional groups

Alcohol
Alkane / alkyl carbon
Alkene
Ether
Ketone

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • 51333-22-3
  • Budenofalk
  • Budesonida
  • Budesonido
  • Budesonidum
  • DTXSID8020202
  • EOHILIA
  • Eltair
Show all 24 synonyms
  • Entocort
  • Entocort EC
  • MAP-0010
  • Preferid
  • Pulmaxan
  • Pulmicort
  • Pulmicort Flexhaler
  • Pulmicort Respules
  • Pulmicort turbuhaler
  • Q3OKS62Q6X
  • Rhinocort
  • Rhinocort Allergy
  • Rhinocort Aqua
  • S-1320
  • Uceris
  • budesonide

Structure identifiers

Canonical SMILES
CCCC1O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@H]4[C@@H](O)C[C@]3(C)[C@]2(C(=O)CO)O1
Isomeric SMILES
CCCC1O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@@]5([C@H]4[C@H](C[C@@]3([C@@]2(O1)C(=O)CO)C)O)C
InChI
InChI=1S/C25H34O6/c1-4-5-21-30-20-11-17-16-7-6-14-10-15(27)8-9-23(14,2)22(16)18(28)12-24(17,3)25(20,31-21)19(29)13-26/h8-10,16-18,20-22,26,28H,4-7,11-13H2,1-3H3/t16-,17-,18-,20+,21?,22+,23-,24-,25+/m0/s1
InChIKey
VOVIALXJUBGFJZ-KWVAZRHASA-N
PubChem CID
5281004

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for (1S,2S,4R,8S,9S,11S,12S,13R)-11-hydroxy-8-(2-hydroxyacetyl)-9,13-dimethyl-6-propyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-16-one; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for (1S,2S,4R,8S,9S,11S,12S,13R)-11-hydroxy-8-(2-hydroxyacetyl)-9,13-dimethyl-6-propyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-16-one; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

Open source record