input word = C00045140

Metabolite InformationStructural formula
Name Yardenone B
(+)-Yardenone B
Formula C30H50O5
Mw 490.36582471
CAS RN 487016-98-8
C_ID C00045140 ,
InChIKey OEBXGHLYXZCVTN-CXSCXJCFNA-N
InChICode InChI=1S/C30H50O5/c1-19-9-10-22-29(8,16-12-21(32)25(2,3)33-22)30(19)18-14-24(35-30)28(7)17-13-23-27(28,6)15-11-20(31)26(4,5)34-23/h19,21-24,32H,9-18H2,1-8H3/t19-,21+,22-,23-,24-,27+,28+,29+,30-/m0/s1
SMILES C[C@H]1CC[C@@H]2OC(C)(C)[C@H](O)CC[C@@]2(C)[C@]12CC[C@@H]([C@@]1(C)CC[C@@H]3OC(C)(C)C(=O)CC[C@]31C)O2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaAxinellidaeAxinella cf. bidderi Ref.
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OrganismAxinella cf. bidderi
ReferenceCarletti,J.Nat.Prod.,66,(2003),25