input word = C00044538

Metabolite InformationStructural formula
Name Armatinol A
(-)-Armatinol A
Formula C30H48O4
Mw 472.35526002
CAS RN 745828-22-2
C_ID C00044538 ,
InChIKey GRJLJZNDSQXXQB-VWMNTASANA-N
InChICode InChI=1S/C30H48O4/c1-18(2)19(3)7-8-20(4)24-9-10-25-23-15-27-30(34-27)16-22(32)11-14-29(30,17-33-21(5)31)26(23)12-13-28(24,25)6/h18,20,22-27,32H,3,7-17H2,1-2,4-6H3/t20-,22-,23-,24+,25-,26-,27+,28+,29-,30+/m0/s1
SMILES C=C(CCC(C)[C@H]1CC[C@H]2[C@@H]3C[C@H]4O[C@]45C[C@@H](O)CC[C@]5(COC(C)=O)[C@H]3CC[C@]12C)C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Nephthea armata Ref.
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