input word = C00049189

Metabolite InformationStructural formula
Name Kadsulactone A
Formula C30H42O5
Mw 482.30322445
CAS RN 132296-71-0
C_ID C00049189 ,
InChIKey APOPUTYAPYVYFW-BEQRJESANA-N
InChICode InChI=1S/C30H42O5/c1-17-7-8-21(34-25(17)33)18(2)19-9-11-28(6)22-15-20(31)24-26(3,4)35-23(32)10-12-30(24)16-29(22,30)14-13-27(19,28)5/h7,10,12,18-22,24,31H,8-9,11,13-16H2,1-6H3/t18-,19+,20+,21-,22-,24-,27+,28-,29?,30-/m0/s1
SMILES C1[C@]23[C@H]([C@]4([C@](C1)([C@H](CC4)[C@@H]([C@H]1OC(=O)C(=CC1)C)C)C)C)C[C@H]([C@@H]1[C@]2(C=CC(=O)OC1(C)C)C3)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSchisandraceaeKadsura heteroclita Ref.
PlantaeSchisandraceaeKadsura lancilimba Ref.
PlantaeSchisandraceaeKadsura peltigera Ref.
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OrganismKadsura lancilimba
ReferenceChen,J.Nat.Prod.,62,(1999),94