Chemical Compound

Trehalose dimycolate

CAS Registry Number 61512-20-7
Trehalose dimycolate chemical structure
Primary Record

Trehalose dimycolate

In stock
1,158 g
Purity
98.6 %
CAS
61512-20-7

Compound Identifiers & Properties

CAS
61512-20-7
PubChem CID
451713
SMILES
CCCCCCCCCCCCCCCCCCCCCCCCCC(C(CCCCCCCCCCC1CC1CCCCCCCCCCCCCCCCCC)C(=O)OCC2C(C(C(C(O2)OC3C(C(C(C(O3)COC(=O)C(CCCCCCCCCCCCCCCCCCCCCCCC)C(CCCCCCCCCCCC4CC4CCCCCCCCCCCCCCCCCC)O)O)O)O)O)O)O)O
Canonical SMILES
CCCCCCCCCCCCCCCCCCCCCCCCCC(O)C(CCCCCCCCCCC1CC1CCCCCCCCCCCCCCCCCC)C(=O)OCC1OC(OC2OC(COC(=O)C(CCCCCCCCCCCCCCCCCCCCCCCC)C(O)CCCCCCCCCCCC3CC3CCCCCCCCCCCCCCCCCC)C(O)C(O)C2O)C(O)C(O)C1O

Names & Synonyms

  • Trehalose dimycolate
  • Cord factor
  • Cord Factor(s)
  • AC1L9PSR
  • RefChem:1100295
  • DTXSID001027586
  • SCHEMBL29362709
  • Mycobacterial trehalose dimycolate
  • DTXCID201513177
  • CID451713
  • Q7837897
  • 61512-20-7
  • TDM
  • [3,4,5-trihydroxy-6-[3,4,5-trihydroxy-6-[2-[1-hydroxy-12-(2-octadecylcyclopropyl)dodecyl]hexacosanoyloxymethyl]oxan-2-yl]oxyoxan-2-yl]methyl 3-hydroxy-2-[10-(2-octadecylcyclopropyl)decyl]octacosanoate
  • [3,4,5-trihydroxy-6-[3,4,5-trihydroxy-6-[2-[1-hydroxy-12-(2-octadecylcyclopropyl)dodecyl]hexacosanoyloxymethyl]tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]methyl 3-hydroxy-2-[10-(2-octadecylcyclopropyl)decyl]octacosanoate