Ergosta-5,24-dien-26-oic acid, 14,20-epoxy-3-(β-D-glucopyranosyloxy)-17,22-dihydroxy-1-oxo-, δ-lactone, (3β,17α,22R)-

CAS Registry Number®

221695-66-5

CAS Name

Ergosta-5,24-dien-26-oic acid, 14,20-epoxy-3-(β-D-glucopyranosyloxy)-17,22-dihydroxy-1-oxo-, δ-lactone, (3β,17α,22R)-

Molecular Formula

C34H48O11

Molecular Mass

632.74

Cite this Page

Ergosta-5,24-dien-26-oic acid, 14,20-epoxy-3-(β-D-glucopyranosyloxy)-17,22-dihydroxy-1-oxo-, δ-lactone, (3β,17α,22R)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=221695-66-5 (retrieved 2024-11-22) (CAS RN: 221695-66-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C34H48O11/c1-16-12-24(44-28(40)17(16)2)32(5)34(41)11-10-33(45-32)21-7-6-18-13-19(42-29-27(39)26(38)25(37)22(15-35)43-29)14-23(36)31(18,4)20(21)8-9-30(33,34)3/h6,19-22,24-27,29,35,37-39,41H,7-15H2,1-5H3/t19-,20+,21-,22-,24-,25-,26+,27-,29-,30+,31+,32+,33-,34+/m1/s1

InChIKey

InChIKey=BVSRDECOTMKNFS-MJJWKRKWSA-N

SMILES

C[C@@]12[C@@]3([C@]4([C@](CC1)([C@]5(C)C(=CC4)C[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC5=O)[H])[H])O[C@](C)([C@]2(O)CC3)[C@]7(CC(C)=C(C)C(=O)O7)[H]

Canonical SMILES

O=C1OC(CC(=C1C)C)C2(OC34CCC2(O)C4(C)CCC5C3CC=C6CC(OC7OC(CO)C(O)C(O)C7O)CC(=O)C65C)C

Other Names for this Substance

  • Ergosta-5,24-dien-26-oic acid, 14,20-epoxy-3-(β-D-glucopyranosyloxy)-17,22-dihydroxy-1-oxo-, δ-lactone, (3β,17α,22R)-

CAS INSIGHTSTM
Targeted protein degrader structure, illustration