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Cymarine A cardiotonic cardiac glycoside isolated from Strophanthus kombe Oliv.
pre_formula_key( "InChIKey=XQCGNURMLWFQJR-AKWNLRILBR", "jqp052/222155.html" ); ?>
pre_formula( "InChI=1/C30H44O9/c1-17-26(33)23(36-3)13-25(38-17)39-19-4-9-28(16-31)21-5-8-27(2)20(18-12-24(32)37-15-18)7-11-30(27,35)22(21)6-10-29(28,34)14-19/h12,16-17,19-23,25-26,33-35H,4-11,13-15H2,1-3H3/t17u,19-,20+,21-,22+,23?,25?,26?,27+,28-,29-,30-/m0/s1", "jqp052/222155.html" ); ?>
Molecular Formula:
C30H44O9
InChI: InChI=1/C30H44O9/c1-17-26(33)23(36-3)13-25(38-17)39-19-4-9-28(16-31)21-5-8-27(2)20(18-12-24(32)37-15-18)7-11-30(27,35)22(21)6-10-29(28,34)14-19/h12,16-17,19-23,25-26,33-35H,4-11,13-15H2,1-3H3/t17u,19-,20+,21-,22+,23?,25?,26?,27+,28-,29-,30-/m0/s1
InChIKey: InChIKey=XQCGNURMLWFQJR-AKWNLRILBR
SMILES: CC1C(C(CC(O1)OC2CCC3(C4CCC5(C(CCC5(C4CCC3(C2)O)O)C6=CC(=O)OC6)C)C=O)OC)O
Names:
Alvonal MR
Alvonal
B 652272K044
CYMARIN
Cymarine
k-Strophanthin-.alpha.
K-STROPHANTHIN
NSC7522
Strophanthin K
WV 90043 a
(3S,5S,8R,9S,10R,13R,14S,17S)-5,14-dihydroxy-3-(5-hydroxy-4-methoxy-6-methyl-oxan-2-yl)oxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
name_it( "InChI=1/C30H44O9/c1-17-26(33)23(36-3)13-25(38-17)39-19-4-9-28(16-31)21-5-8-27(2)20(18-12-24(32)37-15-18)7-11-30(27,35)22(21)6-10-29(28,34)14-19/h12,16-17,19-23,25-26,33-35H,4-11,13-15H2,1-3H3/t17u,19-,20+,21-,22+,23?,25?,26?,27+,28-,29-,30-/m0/s1", "jqp052/222155.html" ); ?>
Registries:
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PubChem CID 222155
PubChem ID 73368
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pre_related( "InChI=1/C30H44O9/c1-17-26(33)23(36-3)13-25(38-17)39-19-4-9-28(16-31)21-5-8-27(2)20(18-12-24(32)37-15-18)7-11-30(27,35)22(21)6-10-29(28,34)14-19/h12,16-17,19-23,25-26,33-35H,4-11,13-15H2,1-3H3/t17u,19-,20+,21-,22+,23?,25?,26?,27+,28-,29-,30-/m0/s1", "jqp052/222155.html" ); ?>