(2β,3β,5β,22R)-25-(β-D-Glucopyranosyloxy)-2,3,14,22-tetrahydroxycholest-7-en-6-one

CAS Registry Number®

112172-82-4

CAS Name

(2β,3β,5β,22R)-25-(β-D-Glucopyranosyloxy)-2,3,14,22-tetrahydroxycholest-7-en-6-one

Molecular Formula

C33H54O11

Molecular Mass

626.78

Cite this Page

(2β,3β,5β,22R)-25-(β-D-Glucopyranosyloxy)-2,3,14,22-tetrahydroxycholest-7-en-6-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=112172-82-4 (retrieved 2024-11-26) (CAS RN: 112172-82-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C33H54O11/c1-16(21(35)8-9-30(2,3)44-29-28(41)27(40)26(39)25(15-34)43-29)17-7-11-33(42)19-12-22(36)20-13-23(37)24(38)14-31(20,4)18(19)6-10-32(17,33)5/h12,16-18,20-21,23-29,34-35,37-42H,6-11,13-15H2,1-5H3

InChIKey

InChIKey=YJBCWBWOULRKGL-UHFFFAOYSA-N

SMILES

OC12C=3C(C4(C)C(C(=O)C3)CC(O)C(O)C4)CCC1(C)C(C(C(CCC(OC5OC(CO)C(O)C(O)C5O)(C)C)O)C)CC2

Canonical SMILES

O=C1C=C2C(CCC3(C)C(CCC23O)C(C)C(O)CCC(OC4OC(CO)C(O)C(O)C4O)(C)C)C5(C)CC(O)C(O)CC15

Other Names for this Substance

  • Cholest-7-en-6-one, 25-(β-D-glucopyranosyloxy)-2,3,14,22-tetrahydroxy-, (2β,3β,5β,22R)-
  • (2β,3β,5β,22R)-25-(β-D-Glucopyranosyloxy)-2,3,14,22-tetrahydroxycholest-7-en-6-one
  • α-Ecdysone 25-O-β-D-glucopyranoside

Deleted or Replaced CAS Registry Numbers

138252-22-9

CAS INSIGHTSTM
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