input word = C00056416

Metabolite InformationStructural formula
Name 14-Hydroxyixocarpanolide
Formula C28H40O7
Mw 488.27740363
CAS RN 107221-65-8
C_ID C00056416
InChIKey SPZVPSAUINZULS-MTIDTWESSA-N
InChICode InChI=1S/C28H40O7/c1-14-13-19(34-23(30)15(14)2)26(5,31)17-9-12-27(32)20-16(8-11-24(17,27)3)25(4)18(29)7-6-10-28(25,33)22-21(20)35-22/h6-7,14-17,19-22,31-33H,8-13H2,1-5H3/t14-,15+,16-,17?,19+,20-,21-,22-,24+,25-,26+,27+,28-/m0/s1
SMILES O=C(O1)[C@H](C)[C@@H](C)C[C@]1([H])[C@@](O)(C)C2CC[C@@]3(O)[C@]4([H])[C@@]5([H])[C@@](O5)([H])[C@@]([C@@]6(C)[C@@]4([H])CC[C@@]32C)(O)CC=CC6=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaePhysalis angulata Ref.
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