input word = C00049149

Metabolite InformationStructural formula
Name Epigermanidiol
Formula C30H50O2
Mw 442.38108084
CAS RN 10179-23-4
C_ID C00049149 ,
InChIKey CZZAATCPIWGYJB-HHBYOJMRNA-N
InChICode InChI=1S/C30H50O2/c1-25(2)13-14-27(5)15-16-29(7)19(20(27)17-25)9-10-23-28(6)18-21(31)24(32)26(3,4)22(28)11-12-30(23,29)8/h17,19,21-24,31-32H,9-16,18H2,1-8H3/t19-,21-,22+,23-,24+,27-,28+,29-,30-/m1/s1
SMILES CC1(C)C=C2[C@H]3CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@@]2(C)CC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeMarsypianthes chamaedrys Ref.
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