3beta,14,19-Trihydroxycarda-5,20(22)-Dienolide
[CAS# 546-03-2]

Identification

• Name: 3beta,14,19-Trihydroxycarda-5,20(22)-Dienolide
• Synonyms: 4-[(3S,10S,13R,14S)-3,14-Dihydroxy-13-Methyl-10-Methylol-1,2,3,4,7,8,9,11,12,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-17-Yl]-5H-Furan-2-One; 4-18-00-02541 (Beilstein Handbook Reference); Brn 0053910
• Molecular Formula: C₂₃H₃₂O₅
• Molecular Weight: 388.50
• CAS Registry Number: 546-03-2
• SMILES: [C@@]13(O)[C@@](C(CC1)C2=CC(OC2)=O)(CCC4C3CC=C5[C@@]4(CC[C@H](O)C5)CO)C
• InChI: 1S/C23H32O5/c1-21-7-5-18-19(3-2-15-11-16(25)4-8-22(15,18)13-24)23(21,27)9-6-17(21)14-10-20(26)28-12-14/h2,10,16-19,24-25,27H,3-9,11-13H2,1H3/t16-,17?,18?,19?,21+,22+,23-/m0/s1
• InChIKey: DUSRIIPEQBGMHU-KQYWMCCWSA-N

Properties

• Density: 1.307g/cm³ (Cal.)
• Boiling point: 614.918°C at 760 mmHg (Cal.)
• Flash point: 213.898°C (Cal.)