input word = C00046691

Metabolite InformationStructural formula
Name Cyclopassifloic acid C
(+)-Cyclopassifloic acid C
Formula C31H52O7
Mw 536.37130401
CAS RN 292167-36-3
C_ID C00046691 ,
InChIKey MXCWXDOOLGFUMA-XBUSKNNTNA-N
InChICode InChI=1S/C31H52O7/c1-18(2)30(38,17-32)14-12-27(5,37)19-9-10-25(3)20-7-8-21-28(6,24(35)36)22(33)15-23(34)31(21)16-29(20,31)13-11-26(19,25)4/h18-23,32-34,37-38H,7-17H2,1-6H3,(H,35,36)/t19-,20-,21-,22-,23-,25-,26+,27-,28-,29-,30+,31+/m0/s1
SMILES CC(C)[C@](O)(CO)CC[C@](C)(O)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4[C@](C)(C(=O)O)[C@@H](O)C[C@H](O)[C@@]45C[C@@]35CC[C@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePassifloraceaePassiflora edulis Ref.
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OrganismPassiflora edulis
ReferenceYoshikawa,J.Nat.Prod.,63,(2000),1229