input word = C00038460

Metabolite InformationStructural formula
Name Anomanolide B
(+)-Anomanolide B
Formula C28H40O8
Mw 504.27231825
CAS RN 937803-40-2
C_ID C00038460 ,
InChIKey YIUICDUSPHFGCI-PVBHIPBGNA-N
InChICode InChI=1S/C28H40O8/c1-23-12-17(18(13-23)36-22(32)26(23,4)33)27(34)10-8-15-14-11-21(31)28(35)20(30)6-5-19(29)25(28,3)16(14)7-9-24(15,27)2/h5-6,14-18,20-21,30-31,33-35H,7-13H2,1-4H3/t14-,15-,16-,17-,18+,20-,21-,23?,24-,25-,26-,27-,28+/m0/s1
SMILES C1=C[C@@H]([C@@]2([C@](C1=O)([C@@H]1[C@@H](C[C@@H]2O)[C@H]2[C@](CC1)([C@](CC2)([C@H]1C[C@]2([C@@](C(=O)O[C@@H]1C2)(C)O)C)O)C)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeTubocapsicum anomalum Ref.
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OrganismTubocapsicum anomalum
ReferenceHeieh,J.Nat.Prod.,70,(2007),747