input word = C00043262

Metabolite InformationStructural formula
Name Aleurodiscal
Formula C30H46O6
Mw 502.3294392
CAS RN 122535-46-0
C_ID C00043262 ,
InChIKey PGDQFMJGCJTDBU-KLGHNZNZNA-N
InChICode InChI=1S/C30H46O6/c1-15(2)19-8-9-30(5)12-23-18(13-31)6-7-20-17(4)26(11-22(20)16(3)21(23)10-24(19)30)36-29-28(34)27(33)25(32)14-35-29/h6,13,15,17,19-21,23-29,32-34H,7-12,14H2,1-5H3/b18-6-,22-16-/t17-,19-,20-,21+,23+,24-,25-,26-,27-,28-,29-,30-/m0/s1
SMILES [C@H]12[C@@H](C(=CC[C@@H]3C(=C1C)C[C@@H]([C@H]3C)O[C@H]1[C@H]([C@H]([C@H](CO1)O)O)O)C=O)C[C@]1([C@@H](C2)[C@@H](CC1)C(C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiAgaricomycetesAleurodiscus mirabilis Ref.
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OrganismAleurodiscus mirabilis
ReferenceZjawiony,J.Nat.Prod.,67,(2004),300