input word = C00045345

Metabolite InformationStructural formula
Name Milolide H
(+)-Milolide H
Formula C28H40O12
Mw 568.25197674
CAS RN 438552-11-5
C_ID C00045345 ,
InChIKey GTYIUTOQPWAZKO-BFIJAXSSNA-N
InChICode InChI=1S/C28H40O12/c1-13-20(37-16(4)30)11-22(39-18(6)32)27(7)21(38-17(5)31)9-8-19(12-36-15(3)29)10-23-28(35,25(33)24(13)27)14(2)26(34)40-23/h10,13-14,20-25,33,35H,8-9,11-12H2,1-7H3/b19-10+/t13-,14-,20+,21-,22-,23-,24+,25+,27-,28-/m0/s1
SMILES CC(=O)OC/C1=C/[C@@H]2OC(=O)[C@H](C)C2(O)[C@H](O)[C@H]2[C@@H](C)[C@H](OC(C)=O)C[C@H](OC(C)=O)[C@]2(C)[C@@H](OC(C)=O)CC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Briareum stechei Ref.
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