input word = C00012549

Metabolite InformationStructural formula
Name Mastigophorene C
[S-(R*,R*)]-3-[[3,4-Dihydroxy-5-(1,2,2-trimethylcyclopentyl)phenyl]methyl]-4-methyl-6-(1,2,2-trimethylcyclopentyl)-1,2-benzenediol
Formula C30H42O4
Mw 466.30830983
CAS RN 118584-11-5
C_ID C00012549 ,
InChIKey MCXRIDOZKCUBHM-REMWNZQGNA-N
InChICode InChI=1S/C30H42O4/c1-18-14-21(29(6)12-8-10-27(29,2)3)26(34)24(32)20(18)15-19-16-22(25(33)23(31)17-19)30(7)13-9-11-28(30,4)5/h14,16-17,31-34H,8-13,15H2,1-7H3/t29-,30-/m1/s1
SMILES c1(c(c(c(cc1[C@]1(CCCC1(C)C)C)C)Cc1cc(c(c(c1)O)O)[C@@]1(C(CCC1)(C)C)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHerbertaceaeHerbertus sakuraii Ref.
--Mastigophora diclados Ref.
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OrganismHerbertus sakuraii
ReferenceIrita,Phytochem.,55,(2000),247