input word = C00041419

Metabolite InformationStructural formula
Name Caminoside D
(-)-Caminoside D
Formula C55H96O23
Mw 1124.63423938
CAS RN 876687-51-3
C_ID C00041419 ,
InChIKey UPKCWUQFRPJDKU-LLBFAQLENA-N
InChICode InChI=1S/C55H96O23/c1-8-12-13-14-15-18-21-27-34(28-22-19-16-17-20-26-31(5)57)71-54-49(44(65)42(63)35(29-56)72-54)77-55-51(78-53-46(67)48(41(62)33(7)70-53)75-38(59)24-10-3)50(76-39(60)25-11-4)47(74-37(58)23-9-2)36(73-55)30-68-52-45(66)43(64)40(61)32(6)69-52/h32-36,40-56,61-67H,8-30H2,1-7H3/t32-,33+,34-,35-,36-,40+,41+,42-,43+,44+,45+,46+,47-,48-,49-,50+,51-,52-,53+,54-,55+/m1/s1
SMILES CCCCCCCCC[C@H](CCCCCCCC(C)=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](CO[C@@H]2O[C@H](C)[C@H](O)[C@H](O)[C@@H]2O)[C@@H](OC(=O)CCC)[C@H](OC(=O)CCC)[C@H]1O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](OC(=O)CCC)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaGeodiidaeCaminus sphaeroconia Ref.
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