input word = C00017527

Metabolite InformationStructural formula
Name 8,8'-Bis(7-hydroxycalamenene)
Formula C30H42O2
Mw 434.31848058
CAS RN 131985-00-7
C_ID C00017527 ,
InChIKey GDRSZELJWZGRKC-XFYGFKRONA-N
InChICode InChI=1S/C30H42O2/c1-15(2)21-11-9-17(5)25-23(21)13-19(7)29(31)27(25)28-26-18(6)10-12-22(16(3)4)24(26)14-20(8)30(28)32/h13-18,21-22,31-32H,9-12H2,1-8H3/t17-,18-,21-,22-/m0/s1
SMILES c1(c(c(c2c(c1)[C@@H](CC[C@@H]2C)C(C)C)c1c(c(cc2c1[C@H](CC[C@H]2C(C)C)C)C)O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMalvaceaeHeritiera ornithocephala Ref.
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OrganismHeritiera ornithocephala
ReferenceCambie,Phytochem.,29,(1990),2329