input word = C00045264

Metabolite InformationStructural formula
Name Clavosolide B
(-)-Clavosolide B
Formula C43H70O16
Mw 842.46638619
CAS RN 407625-26-7
C_ID C00045264 ,
InChIKey ZZLBPQQRKCZRLW-TUHIGCDMNA-N
InChICode InChI=1S/C43H70O16/c1-20-10-26(20)32-14-24-12-28(58-42-38(46)39(49-7)34(47-5)18-52-42)22(3)30(54-24)16-36(44)57-33(27-11-21(27)2)15-25-13-29(23(4)31(55-25)17-37(45)56-32)59-43-41(51-9)40(50-8)35(48-6)19-53-43/h20-35,38-43,46H,10-19H2,1-9H3/t20-,21-,22-,23-,24+,25+,26-,27-,28+,29+,30+,31+,32+,33+,34-,35-,38-,39+,40+,41-,42+,43+/m1/s1
SMILES CO[C@@H]1[C@@H](O)[C@H](O[C@H]2C[C@H]3C[C@@H]([C@@H]4C[C@H]4C)OC(=O)C[C@@H]4O[C@@H](C[C@H](O[C@@H]5OC[C@@H](OC)[C@H](OC)[C@H]5OC)[C@H]4C)C[C@@H]([C@@H]4C[C@H]4C)OC(=O)C[C@H](O3)[C@@H]2C)OC[C@H]1OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Myriastra clavosa Ref.
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OrganismMyriastra clavosa
ReferenceRao,J.Nat.Prod.,65,(2002),386