input word = C00017551

Metabolite InformationStructural formula
Name Spirocardin A
Formula C20H30O6
Mw 366.20423869
CAS RN 99401-76-0
C_ID C00017551 ,
InChIKey BHDYBYAEPPUJEJ-UHFFFAOYNA-N
InChICode InChI=1S/C20H30O6/c1-10-6-5-7-12-18(3,11(2)14(21)15(22)19(10,12)4)8-13-20(9-25-20)16(23)17(24)26-13/h6,11-14,16-17,21,23-24H,5,7-9H2,1-4H3/t11-,12-,13+,14-,16+,17-,18+,19-,20+/m0/s1
SMILES C1=C([C@]2([C@@H](CC1)[C@]([C@H]([C@@H](C2=O)O)C)(C)C[C@H]1O[C@@H]([C@H]([C@]21CO2)O)O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaNocardiaceaeNocardia SANK 64282 Ref.
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