input word = C00044022

Metabolite InformationStructural formula
Name Zhankuic acid B
Formula C29H42O5
Mw 470.30322445
CAS RN 173221-07-3
C_ID C00044022 ,
InChIKey TXEJUZMIQVTZHO-CRJZVJGSNA-N
InChICode InChI=1S/C29H42O5/c1-15(17(3)27(33)34)7-8-16(2)19-9-10-20-25-23(31)13-21-18(4)22(30)11-12-28(21,5)26(25)24(32)14-29(19,20)6/h16-22,30H,1,7-14H2,2-6H3,(H,33,34)/t16-,17+,18+,19-,20+,21+,22-,28+,29-/m1/s1
SMILES C=C(CC[C@@H](C)[C@H]1CC[C@H]2C3=C(C(=O)C[C@]12C)[C@@]1(C)CC[C@@H](O)[C@@H](C)[C@@H]1CC3=O)C(C)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiMeripilaceaeAntrodia camphorata Ref.
FungiMeripilaceaeAntrodia cinnamomea Ref.
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OrganismAntrodia camphorata
ReferenceYang, et al., Planta Med, 70, (2004), 256