input word = C00048791

Metabolite InformationStructural formula
Name Nebrosteroid A
(+)-Nebrosteroid A
Formula C29H48O4
Mw 460.35526002
CAS RN 1122463-29-9
C_ID C00048791 ,
InChIKey QCBCGVWZWOBQEI-DQDOEIDUNA-N
InChICode InChI=1S/C29H48O4/c1-16(2)18(4)23(31)14-17(3)20-8-9-25-28(20,7)15-24(32)26-27(6)12-11-22(30)19(5)21(27)10-13-29(25,26)33/h16-17,19-22,24-26,30,32-33H,4,8-15H2,1-3,5-7H3/t17-,19+,20-,21+,22+,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@](C[C@@H]1O)([C@H](CC2)[C@@H](CC(=O)C(=C)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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