Ergosta-5,24-dien-26-oic acid, 3-(β-D-glucopyranosyloxy)-1,22-dihydroxy-, 2-O-β-D-glucopyranosyl-β-D-glucopyranosyl ester, (1α,3β,22R,24E)-

CAS Registry Number®

155510-73-9

CAS Name

Ergosta-5,24-dien-26-oic acid, 3-(β-D-glucopyranosyloxy)-1,22-dihydroxy-, 2-O-β-D-glucopyranosyl-β-D-glucopyranosyl ester, (1α,3β,22R,24E)-

Molecular Formula

C46H74O20

Molecular Mass

947.07

Cite this Page

Ergosta-5,24-dien-26-oic acid, 3-(β-D-glucopyranosyloxy)-1,22-dihydroxy-, 2-O-β-D-glucopyranosyl-β-D-glucopyranosyl ester, (1α,3β,22R,24E)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=155510-73-9 (retrieved 2024-11-22) (CAS RN: 155510-73-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C46H74O20/c1-18(19(2)41(60)66-44-40(37(57)34(54)30(17-49)64-44)65-43-39(59)36(56)33(53)29(16-48)63-43)12-27(50)20(3)24-8-9-25-23-7-6-21-13-22(61-42-38(58)35(55)32(52)28(15-47)62-42)14-31(51)46(21,5)26(23)10-11-45(24,25)4/h6,20,22-40,42-44,47-59H,7-17H2,1-5H3/b19-18+/t20-,22+,23-,24+,25-,26-,27+,28+,29+,30+,31-,32+,33+,34+,35-,36-,37-,38+,39+,40+,42+,43-,44-,45+,46-/m0/s1

InChIKey

InChIKey=SLKLMANSFWXKFP-MJBZCTIUSA-N

SMILES

C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@@]([C@@H]([C@@H](C/C(=C(/C(O[C@H]5[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@H](O)[C@H](O)[C@@H](CO)O5)=O)\C)/C)O)C)(CC4)[H])[H])(CC=C1C[C@@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)C[C@@H]2O)[H])[H]

Canonical SMILES

O=C(OC1OC(CO)C(O)C(O)C1OC2OC(CO)C(O)C(O)C2O)C(=C(C)CC(O)C(C)C3CCC4C5CC=C6CC(OC7OC(CO)C(O)C(O)C7O)CC(O)C6(C)C5CCC34C)C

Other Names for this Substance

  • Ergosta-5,24-dien-26-oic acid, 3-(β-D-glucopyranosyloxy)-1,22-dihydroxy-, 2-O-β-D-glucopyranosyl-β-D-glucopyranosyl ester, (1α,3β,22R,24E)-

CAS INSIGHTSTM
Targeted protein degrader structure, illustration