(3β,22E)-Ergosta-5,7,22-trien-3-yl β-D-glucopyranoside

CAS Registry Number®

130155-33-8
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CAS Name

(3β,22E)-Ergosta-5,7,22-trien-3-yl β-D-glucopyranoside

Molecular Formula

C34H54O6

Molecular Mass

558.79

Cite this Page

(3β,22E)-Ergosta-5,7,22-trien-3-yl β-D-glucopyranoside.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=130155-33-8 (retrieved 2024-05-19) (CAS RN: 130155-33-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    308 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C34H54O6/c1-19(2)20(3)7-8-21(4)25-11-12-26-24-10-9-22-17-23(13-15-33(22,5)27(24)14-16-34(25,26)6)39-32-31(38)30(37)29(36)28(18-35)40-32/h7-10,19-21,23,25-32,35-38H,11-18H2,1-6H3/b8-7+/t20-,21+,23-,25+,26-,27-,28+,29+,30-,31+,32+,33-,34+/m0/s1

InChIKey

InChIKey=MKZPNGBJJJZJMI-GBLVNJONSA-N

SMILES

C[C@@]12[C@](C=3[C@@]([C@]4(C)C(=CC3)C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC4)(CC1)[H])(CC[C@@]2([C@@H](/C=C/[C@@H](C(C)C)C)C)[H])[H]

Canonical SMILES

OCC1OC(OC2CC3=CC=C4C(CCC5(C)C4CCC5C(C=CC(C)C(C)C)C)C3(C)CC2)C(O)C(O)C1O

Other Names for this Substance

  • β-D-Glucopyranoside, (3β,22E)-ergosta-5,7,22-trien-3-yl
  • Ergostane, β-D-glucopyranoside deriv.
  • (3β,22E)-Ergosta-5,7,22-trien-3-yl β-D-glucopyranoside
  • Ergosterol β-D-glucopyranoside
  • (22E,24R)-Ergosta-5,7,22-trien-3β-ol 3-O-β-D-glucopyranoside

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