Cholest-4-en-3-one, 7-[[2-(acetylamino)-2-deoxy-β-D-glucopyranosyl]oxy]-26-(acetyloxy)-, (7α,25R)-

CAS Registry Number®

94426-01-4
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CAS Name

Cholest-4-en-3-one, 7-[[2-(acetylamino)-2-deoxy-β-D-glucopyranosyl]oxy]-26-(acetyloxy)-, (7α,25R)-

Molecular Formula

C37H59NO9

Molecular Mass

661.87

Cite this Page

Cholest-4-en-3-one, 7-[[2-(acetylamino)-2-deoxy-β-D-glucopyranosyl]oxy]-26-(acetyloxy)-, (7α,25R)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=94426-01-4 (retrieved 2024-05-06) (CAS RN: 94426-01-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C37H59NO9/c1-20(19-45-23(4)41)8-7-9-21(2)26-10-11-27-31-28(13-15-37(26,27)6)36(5)14-12-25(42)16-24(36)17-29(31)46-35-32(38-22(3)40)34(44)33(43)30(18-39)47-35/h16,20-21,26-35,39,43-44H,7-15,17-19H2,1-6H3,(H,38,40)

InChIKey

InChIKey=BRNQQEJYQPMDNG-UHFFFAOYSA-N

SMILES

O(C1C2C3C(C)(C(C(CCCC(COC(C)=O)C)C)CC3)CCC2C4(C)C(C1)=CC(=O)CC4)C5C(NC(C)=O)C(O)C(O)C(CO)O5

Canonical SMILES

O=C(OCC(C)CCCC(C)C1CCC2C3C(OC4OC(CO)C(O)C(O)C4NC(=O)C)CC5=CC(=O)CCC5(C)C3CCC12C)C

Other Names for this Substance

  • Cholest-4-en-3-one, 7-[[2-(acetylamino)-2-deoxy-β-D-glucopyranosyl]oxy]-26-(acetyloxy)-, (7α,25R)-
  • Pavoninin 1

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