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 [C@@H]1([C@@H]([C@H]([C@@H](OC1)O[C@H]1C[C@@H]2O[C@H]([C@@H]1C)CC(=O)O[C@@H](C[C@H]1O[C@@H](CC(=O)O[C@@H](C2)[C@H]2[C@@H](C2)C)[C@@H]([C@H](C1)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)OC)OC)C)[C@H]1[C@@H](C1)C)OC)OC)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Myriastra clavosa Ref.
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