input word = C00039766

Metabolite InformationStructural formula
Name Micrandilactone B
(+)-Micrandilactone B
Formula C29H40O8
Mw 516.27231825
CAS RN 861888-12-2
C_ID C00039766 ,
InChIKey NOPJKUNZSJEAIR-ULQMVKNTNA-N
InChICode InChI=1S/C29H40O8/c1-14-10-17(34-24(14)32)23(31)15(2)16-11-21-29(36-21)19-7-6-18-25(3,4)35-20-12-22(30)37-28(18,20)13-27(19,33)9-8-26(16,29)5/h10,15-21,23,31,33H,6-9,11-13H2,1-5H3/t15-,16+,17-,18-,19+,20+,21-,23-,26+,27-,28+,29-/m0/s1
SMILES [C@@]123[C@@H](CC[C@@H]4[C@@](C1)(CC[C@]1([C@]54[C@H](C[C@@H]1[C@@H]([C@@H]([C@H]1OC(=O)C(=C1)C)O)C)O5)C)O)C(O[C@@H]2CC(=O)O3)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSchisandraceaeKadsura coccinea Ref.
PlantaeSchisandraceaeSchisandra propinqua var.propinqua Ref.
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OrganismKadsura coccinea
ReferenceGao,J.Nat.Prod.,71,(2008),1182