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 C1[C@@H]([C@@]([C@H]2[C@]3([C@H]1O)[C@]1([C@@H](CC2)[C@]2([C@](CC1)([C@H](CC2)[C@](CC[C@@](O)(CO)C(C)C)(O)C)C)C)C3)(C)C(=O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePassifloraceaePassiflora edulis Ref.
zoom in