Scillirosidin
CAS Registry Number®
507-59-5
CAS Name
ScillirosidinMolecular Formula
C26H34O7Molecular Mass
458.54Cite this Page
Scillirosidin. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=507-59-5 (retrieved ) (CAS RN: 507-59-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
173-175 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C26H34O7/c1-15(27)33-20-13-25(30)21(23(2)9-6-17(28)12-19(20)23)8-10-24(3)18(7-11-26(24,25)31)16-4-5-22(29)32-14-16/h4-5,12,14,17-18,20-21,28,30-31H,6-11,13H2,1-3H3/t17-,18+,20+,21+,23-,24+,25-,26+/m0/s1
InChIKey
InChIKey=SOJXCEWHLPYBAF-KDVWZPTCSA-N
SMILES
O[C@@]12[C@@]3(O)[C@@]([C@]4(C)C([C@H](OC(C)=O)C3)=C[C@@H](O)CC4)(CC[C@]1(C)[C@H](CC2)C=5C=CC(=O)OC5)[H]
Canonical SMILES
O=C1OC=C(C=C1)C2CCC3(O)C4(O)CC(OC(=O)C)C5=CC(O)CCC5(C)C4CCC23C
Other Names for this Substance
- Bufa-4,20,22-trienolide, 6-(acetyloxy)-3,8,14-trihydroxy-, (3β,6β)-
- Bufa-4,20,22-trienolide, 3β,6β,8,14-tetrahydroxy-, 6-acetate
- Scillirosidin
- (3β,6β)-6-(Acetyloxy)-3,8,14-trihydroxybufa-4,20,22-trienolide
- NSC 7534
Deleted or Replaced CAS Registry Numbers
6283-48-3, 25875-37-0