input word = C00048126

Metabolite InformationStructural formula
Name Siphonellinol D
(-)-Siphonellinol D
Formula C30H52O4
Mw 476.38656015
CAS RN 1169792-86-2
C_ID C00048126 ,
InChIKey QNKHJWWGRVWAAY-IYWWLUDDNA-N
InChICode InChI=1S/C30H52O4/c1-20(2)10-9-17-28(6)22(21(3)11-14-25(28)32)12-13-23-29(7)18-15-24(31)27(4,5)34-26(29)16-19-30(23,8)33/h10,23-26,31-33H,9,11-19H2,1-8H3/t23-,24-,25+,26-,28-,29-,30-/m0/s1
SMILES [C@@H]1([C@](C(=C(CC1)C)CC[C@H]1[C@]2([C@H](CC[C@]1(C)O)OC([C@H](CC2)O)(C)C)C)(CCC=C(C)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Callyspongia siphonella Ref.
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OrganismCallyspongia siphonella
ReferenceJain,J.Nat.Prod.,72,(2009),1291