input word = C00045152

Metabolite InformationStructural formula
Name 12beta,22-Dihydroxy-24-methylscalar-17-en-24,25-olide
Formula C26H40O4
Mw 416.29265977
CAS RN 85337-13-9
C_ID C00045152 ,
InChIKey CGYKWNAZXSRFCL-JYBWSXMWNA-N
InChICode InChI=1S/C26H40O4/c1-15-16-7-8-18-24(4)12-9-17-23(2,3)10-6-11-26(17,14-27)19(24)13-20(28)25(18,5)21(16)22(29)30-15/h15,17-20,27-28H,6-14H2,1-5H3/t15-,17-,18-,19-,20+,24-,25+,26+/m0/s1
SMILES C1CC([C@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@H]2[C@]([C@@H](C1)O)(C1=C(CC2)[C@@H](OC1=O)C)C)C)CO)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Lendenfeldia frondosa Ref.
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