Withanolide D
CAS Registry Number®
30655-48-2
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CAS Name
Withanolide DMolecular Formula
C28H38O6Molecular Mass
470.60Cite this Page
Withanolide D. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=30655-48-2 (retrieved ) (CAS RN: 30655-48-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
253-255 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C28H38O6/c1-14-12-22(33-24(31)15(14)2)27(5,32)19-7-6-17-16-13-23-28(34-23)21(30)9-8-20(29)26(28,4)18(16)10-11-25(17,19)3/h8-9,16-19,21-23,30,32H,6-7,10-13H2,1-5H3/t16-,17-,18-,19-,21-,22+,23+,25-,26-,27+,28+/m0/s1
InChIKey
InChIKey=SASUFNRGCZMRFD-JCUIILOWSA-N
SMILES
C[C@]12[C@]3([C@](O3)(C[C@@]4([C@@]1(CC[C@@]5(C)[C@]4(CC[C@@]5([C@@](C)(O)[C@]6(CC(C)=C(C)C(=O)O6)[H])[H])[H])[H])[H])[H])[C@@H](O)C=CC2=O
Canonical SMILES
O=C1OC(CC(=C1C)C)C(O)(C)C2CCC3C4CC5OC65C(O)C=CC(=O)C6(C)C4CCC32C
Other Names for this Substance
- Ergosta-2,24-dien-26-oic acid, 5,6-epoxy-4,20,22-trihydroxy-1-oxo-, δ-lactone, (4β,5β,6β,22R)-
- 5β-Ergosta-2,24-dien-26-oic acid, 5,6β-epoxy-4β,20,22-trihydroxy-1-oxo-, δ-lactone, (20S,22R)-
- 5,6-Epoxy-5H-cyclopenta[a]phenanthrene, ergosta-2,24-dien-26-oic acid deriv.
- Withanolide D
- NSC 179841
Deleted or Replaced CAS Registry Numbers
22848-73-3
