input word = C00012997

Metabolite InformationStructural formula
Name Nitrosin
[3R-(3alpha,3abeta,5aalpha,6alpha,9abeta,9balpha)]-6-(Acetyloxy)decahydro-9a-hydroxy-3,5a-dimethyl-9-methylenenaphtho[1,2-b]furan-2(3H)-one
Formula C17H24O5
Mw 308.16237388
CAS RN 36313-00-5
C_ID C00012997 ,
InChIKey CYTCTRAEJYIZRX-OEHIOSLENA-N
InChICode InChI=1S/C17H24O5/c1-9-5-6-13(21-11(3)18)16(4)8-7-12-10(2)15(19)22-14(12)17(9,16)20/h10,12-14,20H,1,5-8H2,2-4H3/t10-,12+,13-,14+,16+,17+/m1/s1
SMILES C=C1CC[C@@H](OC(C)=O)[C@]2(C)CC[C@H]3[C@@H](C)C(=O)O[C@@H]3[C@@]12O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArtemisia nitrosa Ref.
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