Primary Record
Papulacandin B
- In stock
- 1,035 g
- Purity
- 99.8 %
- CAS
- 61032-80-2
Compound Identifiers & Properties
- CAS
- 61032-80-2
- PubChem CID
- 101090617
- SMILES
- CC[C@H](C)CC/C=C/C=C(\C)/[C@H](C/C=C/C=C/C(=O)O[C@H]1[C@@H]([C@H](O[C@]2([C@@H]1O)C3=C(CO2)C=C(C=C3O)O)CO)O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)COC(=O)/C=C/C=C\C=C\C(CC)O)O)O)O)O
- Canonical SMILES
- CCC(O)/C=C/C=C\C=C\C(=O)OC[C@H]1O[C@@H](O[C@H]2[C@H](OC(=O)/C=C/C=C/C[C@H](O)/C(C)=C/C=C/CC[C@@H](C)CC)[C@@H](O)[C@@]3(OCc4cc(O)cc(O)c43)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O
Names & Synonyms
- Papulacandin B
- papulacandin-B
- CHEMBL4764624
- CHEBI:569624
- C47H64O17
- C47-H64-O17
- A-32283-B
- J1.468.915J
- (1S,3'R,4'R,5'R,6'R)-3',5,7-trihydroxy-5'-({6-O-[(2E,4Z,6E)-8-hydroxydeca-2,4,6-trienoyl]-beta-D-galactopyranosyl}oxy)-6'-(hydroxymethyl)-3',4',5',6'-tetrahydro-3H-spiro[2-benzofuran-1,2'-pyran]-4'-yl (2E,4E,7S,8E,10E,14S)-7-hydroxy-8,14-dimethylhexadeca-2,4,8,10-tetraenoate
- 61032-80-2
- (1S,3'R,4'R,5'R,6'R)-3',5,7-trihydroxy-6'-(hydroxymethyl)-5'-{[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-({[(2E,4Z,6E)-8-hydroxydeca-2,4,6-trienoyl]oxy}methyl)oxan-2-yl]oxy}-3H-spiro[2-benzofuran-1,2'-oxan]-4'-yl (2E,4E,7S,8E,10E,14S)-7-hydroxy-8,14-dimethylhexadeca-2,4,8,10-tetraenoate
- 1,1-O-(4,6-Dihydroxy-1,2-phenylenemethylene)-4-O-[6-O-[(2E,4Z,6E)-1-oxo-8-hydroxy-2,4,6-decatrienyl]-beta-D-galactopyranosyl]-alpha-D-glucopyranose 3-[(2E,4E,7S,8E,10E,14S)-7-hydroxy-8,14-dimethylhexadeca-2,4,8,10-tetraenoate]