input word = C00041855

Metabolite InformationStructural formula
Name Scopararane A
(+)-Scopararane A
Formula C20H28O5
Mw 348.193674
CAS RN 888958-45-0
C_ID C00041855 ,
InChIKey KPUJVADRTZEHMX-RHKZOZTBNA-N
InChICode InChI=1S/C20H28O5/c1-5-16(4)9-10-18(22)13(11-16)14(21)19(23)20(24)15(2,3)7-6-8-17(18,20)12-25-19/h5,11,22-24H,1,6-10,12H2,2-4H3/t16-,17-,18+,19+,20+/m0/s1
SMILES C1[C@@]23[C@](C(CC1)(C)C)([C@](C(=O)C1=C[C@@](CC[C@]21O)(C)C=C)(O)OC3)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiDiatrypaceaeEutypella scoparia PSU-D44 Ref.
FungiDiatrypaceaeEutypella sp. BCC13199 Ref.
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OrganismEutypella scoparia PSU-D44
ReferencePongcharen,J.Nat.Prod.,69,(2006),856