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CAS 50299-45-1

:

(2β,3β,5β,22R,24R)-2,3,5,14,20,22,25-Heptahydroxyergost-7-en-6-one

Description:
The chemical substance known as "(2β,3β,5β,22R,24R)-2,3,5,14,20,22,25-Heptahydroxyergost-7-en-6-one," with the CAS number 50299-45-1, is a sterol derivative characterized by a complex polycyclic structure typical of ergosterol and its derivatives. This compound features multiple hydroxyl (-OH) groups, which contribute to its hydrophilicity and influence its biological activity. The presence of a ketone functional group at the 6-position further modifies its chemical properties. The specific stereochemistry indicated by the β and R designations suggests a particular three-dimensional arrangement of atoms, which is crucial for its interaction with biological systems. This compound is often studied for its potential pharmacological effects, including antifungal and cholesterol-lowering properties, due to its structural similarity to cholesterol. Its solubility, stability, and reactivity can vary significantly based on the functional groups present, making it an interesting subject for research in biochemistry and medicinal chemistry.
Formula:C28H46O8
InChI:InChI=1S/C28H46O8/c1-15(23(2,3)33)11-21(31)26(6,34)20-8-10-27(35)17-12-22(32)28(36)14-19(30)18(29)13-25(28,5)16(17)7-9-24(20,27)4/h12,15-16,18-21,29-31,33-36H,7-11,13-14H2,1-6H3/t15-,16+,18+,19-,20+,21-,24-,25-,26-,27-,28-/m1/s1
InChI key:InChIKey=LMQKRCYKYDRRFC-KDZLJHQNSA-N
SMILES:O[C@]12C=3[C@@]([C@]4(C)[C@](O)(C(=O)C3)C[C@@H](O)[C@@H](O)C4)(CC[C@]1(C)[C@@]([C@@]([C@@H](C[C@H](C(C)(C)O)C)O)(C)O)(CC2)[H])[H]
Synonyms:
  • Ergost-7-en-6-one, 2,3,5,14,20,22,25-heptahydroxy-, (2β,3β,5β,22R,24R)-
  • Dacrysterone
  • (2β,3β,5β,22R,24R)-2,3,5,14,20,22,25-Heptahydroxyergost-7-en-6-one
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