input word = C00023464

Metabolite InformationStructural formula
Name Rotalin A
Formula C20H32O
Mw 288.24531564
CAS RN 119979-81-6
C_ID C00023464 ,
InChIKey UUHUTIDTORHNMI-FKGPXSGXNA-N
InChICode InChI=1S/C20H32O/c1-7-18(5)12-13-20(21-18)15(3)8-9-17-16(4)14(2)10-11-19(17,20)6/h7,14-15,17H,1,4,8-13H2,2-3,5-6H3/t14-,15-,17+,18-,19+,20-/m1/s1
SMILES C1[C@H](C(=C)[C@H]2[C@](C1)([C@@]1([C@@H](CC2)C)O[C@](CC1)(C)C=C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Mycale rotalis Ref.
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