input word = C00035512

Metabolite InformationStructural formula
Name 7-Epicandicandiol
Formula C20H32O2
Mw 304.24023027
CAS RN 33769-62-9
C_ID C00035512 ,
InChIKey AMOBKAMJSKCUFH-IXZHKOEWNA-N
InChICode InChI=1S/C20H32O2/c1-13-10-20-11-14(13)5-6-15(20)19(3)8-4-7-18(2,12-21)16(19)9-17(20)22/h14-17,21-22H,1,4-12H2,2-3H3/t14-,15+,16-,17+,18-,19+,20+/m1/s1
SMILES C1C[C@@]([C@@H]2[C@@](C1)([C@H]1[C@@]3([C@H](C2)O)C[C@@H](CC1)C(=C)C3)C)(CO)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeSideritis ozturkii Aytac & Aksoy Ref.
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