input word = C00045160

Metabolite InformationStructural formula
Name 16-Hydroxymilolide M
(+)-16-Hydroxymilolide M
Formula C28H38O12
Mw 566.23632668
CAS RN 438552-17-1
C_ID C00045160 ,
InChIKey ZCCOSAFBTMVYPD-VVIHAZRQNA-N
InChICode InChI=1S/C28H38O12/c1-13-8-9-21(37-16(4)31)27(7)22(38-17(5)32)11-20(36-15(3)30)19(12-29)10-23-28(35,14(2)26(34)40-23)25(24(13)27)39-18(6)33/h8,10,14,20-25,29,35H,9,11-12H2,1-7H3/b19-10-/t14-,20+,21-,22-,23-,24+,25+,27+,28-/m0/s1
SMILES C\1=C(\[C@@H](C[C@@H]([C@@]2([C@@H]([C@H]([C@]3([C@H]1OC(=O)[C@@H]3C)O)OC(=O)C)C(=CC[C@@H]2OC(=O)C)C)C)OC(=O)C)OC(=O)C)/CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Briareum stechei Ref.
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OrganismBriareum stechei
ReferenceKwak,J.Nat.Prod.,65,(2002),704