input word = C00029720

Metabolite InformationStructural formula
Name Arganine Q
Formula C41H64O15
Mw 796.42452138
CAS RN 1028483-92-2
C_ID C00029720 ,
InChIKey LGPCYQZICLPFSK-YOECWLLRNA-N
InChICode InChI=1S/C41H64O15/c1-36(2)11-13-41(35(51)52)14-12-39(5)19(20(41)15-36)7-8-24-37(3)16-21(43)31(38(4,18-42)23(37)9-10-40(24,39)6)56-34-28(48)26(46)29(30(55-34)32(49)50)54-33-27(47)25(45)22(44)17-53-33/h7,20-31,33-34,42-48H,8-18H2,1-6H3,(H,49,50)(H,51,52)/t20-,21-,22+,23+,24+,25-,26+,27+,28+,29-,30-,31-,33-,34-,37-,38-,39+,40+,41-/m0/s1
SMILES CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@H](O)[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)C(C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSapotaceaeArgania spinosa Ref.
zoom in