input word = C00048798

Metabolite InformationStructural formula
Name Nebrosteroid H
(+)-Nebrosteroid H
Formula C29H50O3
Mw 446.37599546
CAS RN 1122463-44-8
C_ID C00048798 ,
InChIKey QSVYDJZQBSBTGS-LWJVNPBPNA-N
InChICode InChI=1S/C29H50O3/c1-18(2)21(17-30)8-7-19(3)22-9-10-25-27(22,5)15-13-26-28(6)14-12-24(31)20(4)23(28)11-16-29(25,26)32/h8,18-20,22-26,30-32H,7,9-17H2,1-6H3/b21-8+/t19-,20+,22-,23+,24+,25-,26-,27-,28+,29-/m1/s1
SMILES C1[C@@H]([C@H]([C@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@H]2[C@](CC1)([C@H](CC2)[C@@H](C/C=C(\CO)/C(C)C)C)C)O)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Nephthea chabroli Ref.
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OrganismNephthea chabroli
ReferenceBlunt,Nat.Prod.Rep.,27,(2010),165