proscillaridin

Proscillaridin A cardiotonic glycoside isolated from Scilla maritima var. alba (Squill).

[1. A cardiotonic agent prepared from squill, the sea onion Urginea maritima.

Molecular Formula: C₃₀H₄₂O₈

InChI: InChI=1/C30H42O8/c1-16-24(32)25(33)26(34)27(37-16)38-19-8-11-28(2)18(14-19)5-6-22-21(28)9-12-29(3)20(10-13-30(22,29)35)17-4-7-23(31)36-15-17/h4,7,14-16,19-22,24-27,32-35H,5-6,8-13H2,1-3H3/t16u,19-,20+,21-,22u,24?,25?,26?,27?,28u,29u,30?/m0/s1

InChIKey: InChIKey=MYEJFUXQJGHEQK-FRCVUFDKBE
SMILES: CC1C(C(C(C(O1)OC2CCC3(C4CCC5(C(CCC5(C4CCC3=C2)O)C6=COC(=O)C=C6)C)C)O)O)O

Names:
    proscillaridin
    12041-88-2
    5-[(3S,9S,17S)-14-hydroxy-10,13-dimethyl-3-(3,4,5-trihydroxy-6-methyl-oxan-2-yl)oxy-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pyran-2-one

Registries:
    PubChem CID 25496
    PubChem ID 168268