| CAS Number | 25633-33-4 |
| Catalog Number | AG00BNAK(AGN-PC-0R1G0Y) |
| Chemical Name | Cerberin |
| IUPAC Name | [(2R,3S,4R,5S,6S)-5-hydroxy-2-[[(3S,5R,8R,9S,10S,13R,14S,17R)-14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-methoxy-6-methyloxan-3-yl] acetate |
| InChI | InChI=1S/C32H48O9/c1-17-26(35)27(37-5)28(40-18(2)33)29(39-17)41-21-8-11-30(3)20(15-21)6-7-24-23(30)9-12-31(4)22(10-13-32(24,31)36)19-14-25(34)38-16-19/h14,17,20-24,26-29,35-36H,6-13,15-16H2,1-5H3/t17-,20+,21-,22+,23-,24+,26-,27+,28-,29-,30-,31+,32-/m0/s1 |
| InChI Key | UYQMTWMXBKEHJQ-IVHDSYOHSA-N |
| MDL Number | MFCD00171624 |
| Molecular Formula | C32H48O9 |
| Molecular Weight | 576.7181 |
| SMILES | O[C@@]12[C@@]3([H])[C@@](CC[C@@]1([C@](C(CO4)=CC4=O)([H])CC2)C)([H])[C@@]5([C@](C[C@H](CC5)O[C@H]6[C@H]([C@@H]([C@H]([C@@H](O6)C)O)OC)OC(C)=O)([H])CC3)C |
| UNII | KW5A155S64 |
| Synonyms | cerberin,
Cerberin,
2'-acetylneriifolin,
UNII-KW5A155S64,
25633-33-4,
CHEBI:75049,
KW5A155S64,
Pveneniferin,
Neriifolin-monoacetat,
SCHEMBL868106,
CHEMBL554969,
C19984,
3beta-O-(L-2'-O-acetylthevetosyl)-14beta-hydroxy-5beta-card-20(22)-enolide,
(3beta,5beta)-3-[(2-O-acetyl-6-deoxy-3-O-methyl-alpha-L-glucopyranosyl)oxy]-14-hydroxycard-20(22)-enolide,
Acetylneriifolin,
Pveneniferin [German],
Acetylneriifolin [German],
Neriifolin-monoacetat [German],
NSC692995,
C32-H48-O9,
CID10031063,
3-((2-O-Acetyl-6-deoxy-3-O-methyl-alpha-L-glucopyranosyl)oxy)-14-hydroxycard-20(22)-endolide (3beta,5beta)-,
3-((4-O-Acetyl-6-deoxy-3-O-methyl-alpha-L-glucopyranosyl)oxy)-14-hydroxy-(3beta,5beta)-card-20(22)-enolide,
5-beta-Card-20(22)-enolide, 3-beta-((6-deoxy-3-O-methyl-beta-L-glucopyranosyl)oxy)-14-hydroxy-, 4'-acetate,
Card-20(22)-endolide, 3-((2-O-acetyl-6-deoxy-3-O-methyl-alpha-L-glucopyranosyl)oxy)-14-hydroxy-, (3beta,5beta)-,
Card-20(22)-enolide, 3-[(2-O-acetyl-6-deoxy-3-O-methyl-.alpha.-L-glucopyranosyl)oxy]-14-hydroxy-, (3.beta.,5.beta.)-,
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