input word = C00034338

Metabolite InformationStructural formula
Name Wightianol B
Formula C30H50O4
Mw 474.37091008
CAS RN 77311-65-0
C_ID C00034338 ,
InChIKey MRQRSMCZZRLXJG-GVAVOEMANA-N
InChICode InChI=1S/C30H50O4/c1-26(2)21-9-7-18-15-27(3)13-11-23-28(4,14-12-24(33)30(23,6)17-31)22(27)10-8-19(18)29(21,5)16-20(32)25(26)34/h7,19-25,31-34H,8-17H2,1-6H3/t19-,20+,21+,22-,23+,24-,25+,27-,28+,29+,30+/m0/s1
SMILES C1[C@H]2C(=CC[C@H]3[C@@]2(C[C@H]([C@H](C3(C)C)O)O)C)C[C@]2([C@H](C1)[C@@]1([C@@H](CC2)[C@@]([C@H](CC1)O)(C)CO)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLycopodiaceaeDiphasiastrum complanatum L.Holub Ref.
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