input word = C00049986

Metabolite InformationStructural formula
Name Angustanoic acid B
(-)-Angustanoic acid B
Formula C20H28O4
Mw 332.19875938
CAS RN 211814-26-5
C_ID C00049986 ,
InChIKey WMBGNPQDZHRODL-NZNXCEQHNA-N
InChICode InChI=1S/C20H28O4/c1-13(2)19-10-11-20(24-23-19)14(12-19)6-7-15-17(3,16(21)22)8-5-9-18(15,20)4/h12,15H,1,5-11H2,2-4H3,(H,21,22)/t15-,17-,18-,19-,20+/m0/s1
SMILES C=C(C)[C@@]12C=C3CC[C@@H]4[C@](C)(CCC[C@]4(C)C(=O)O)[C@]3(CC1)OO2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeIlliciaceaeIllicium angustisepalum Ref.
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