(3β,5β)-5-(Acetyloxy)-3-[(6-deoxy-α-L-mannopyranosyl)oxy]-14-hydroxy-19-oxobufa-20,22-dienolide
CAS Registry Number®
93802-98-3
CAS Name
(3β,5β)-5-(Acetyloxy)-3-[(6-deoxy-α-L-mannopyranosyl)oxy]-14-hydroxy-19-oxobufa-20,22-dienolideMolecular Formula
C32H44O11Molecular Mass
604.69Cite this Page
(3β,5β)-5-(Acetyloxy)-3-[(6-deoxy-α-L-mannopyranosyl)oxy]-14-hydroxy-19-oxobufa-20,22-dienolide. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=93802-98-3 (retrieved ) (CAS RN: 93802-98-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C32H44O11/c1-17-25(36)26(37)27(38)28(41-17)42-20-6-11-30(16-33)22-7-10-29(3)21(19-4-5-24(35)40-15-19)9-13-32(29,39)23(22)8-12-31(30,14-20)43-18(2)34/h4-5,15-17,20-23,25-28,36-39H,6-14H2,1-3H3
InChIKey
InChIKey=IKNIMVNUBXHADS-UHFFFAOYSA-N
SMILES
C(=O)C12C(OC(C)=O)(CC(OC3C(O)C(O)C(O)C(C)O3)CC1)CCC4C2CCC5(C)C4(O)CCC5C=6C=CC(=O)OC6
Canonical SMILES
O=CC12CCC(OC3OC(C)C(O)C(O)C3O)CC2(OC(=O)C)CCC4C1CCC5(C)C(C6=COC(=O)C=C6)CCC45O
Other Names for this Substance
- Bufa-20,22-dienolide, 5-(acetyloxy)-3-[(6-deoxy-α-L-mannopyranosyl)oxy]-14-hydroxy-19-oxo-, (3β,5β)-
- (3β,5β)-5-(Acetyloxy)-3-[(6-deoxy-α-L-mannopyranosyl)oxy]-14-hydroxy-19-oxobufa-20,22-dienolide
- Lanceotoxin B