Ergosta-2,24-dien-26-oic acid, 5,6-epoxy-4,11,22,27-tetrahydroxy-1-oxo-, δ-lactone, (4β,5β,6β,11β,22R)-

CAS Registry Number®

1350448-44-0

CAS Name

Ergosta-2,24-dien-26-oic acid, 5,6-epoxy-4,11,22,27-tetrahydroxy-1-oxo-, δ-lactone, (4β,5β,6β,11β,22R)-

Molecular Formula

C28H38O7

Molecular Mass

486.60

Cite this Page

Ergosta-2,24-dien-26-oic acid, 5,6-epoxy-4,11,22,27-tetrahydroxy-1-oxo-, δ-lactone, (4β,5β,6β,11β,22R)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1350448-44-0 (retrieved 2024-11-22) (CAS RN: 1350448-44-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C28H38O7/c1-13-9-20(34-25(33)16(13)12-29)14(2)17-5-6-18-15-10-23-28(35-23)22(32)8-7-21(31)27(28,4)24(15)19(30)11-26(17,18)3/h7-8,14-15,17-20,22-24,29-30,32H,5-6,9-12H2,1-4H3/t14-,15-,17+,18-,19-,20+,22-,23+,24+,26+,27+,28+/m0/s1

InChIKey

InChIKey=UPRPPTFVJBNIPP-VAPFTTHESA-N

SMILES

C[C@]12[C@]3([C@](O3)(C[C@@]4([C@@]1([C@@H](O)C[C@@]5(C)[C@]4(CC[C@@]5([C@H](C)[C@]6(CC(C)=C(CO)C(=O)O6)[H])[H])[H])[H])[H])[H])[C@@H](O)C=CC2=O

Canonical SMILES

O=C1OC(CC(=C1CO)C)C(C)C2CCC3C4CC5OC65C(O)C=CC(=O)C6(C)C4C(O)CC23C

Other Names for this Substance

  • Ergosta-2,24-dien-26-oic acid, 5,6-epoxy-4,11,22,27-tetrahydroxy-1-oxo-, δ-lactone, (4β,5β,6β,11β,22R)-
  • Withalongolide C

CAS INSIGHTSTM
Targeted protein degrader structure, illustration