input word = C00033699

Metabolite InformationStructural formula
Name Caratuberside G
(+)-Caratuberside G
Formula C62H88O21
Mw 1168.58180988
CAS RN 1070419-09-8
C_ID C00033699 ,
InChIKey SXTZIDNXMZXWCP-UFMBOHNBNA-N
InChICode InChI=1S/C62H88O21/c1-31(76-56(68)35-16-12-10-13-17-35)39-23-25-62(70)40-21-20-37-26-38(22-24-60(37,5)41(40)27-45(61(39,62)6)80-57(69)36-18-14-11-15-19-36)78-46-28-42(71-7)52(32(2)74-46)81-47-29-43(72-8)53(33(3)75-47)82-59-51(67)55(73-9)54(34(4)77-59)83-58-50(66)49(65)48(64)44(30-63)79-58/h10-20,31-34,38-55,58-59,63-67,70H,21-30H2,1-9H3/t31-,32+,33+,34+,38-,39+,40+,41-,42-,43-,44+,45+,46-,47-,48-,49-,50+,51+,52+,53+,54+,55+,58-,59-,60-,61-,62-/m0/s1
SMILES CO[C@H]1[C@@H](O)[C@H](O[C@H]2[C@@H](OC)C[C@H](O[C@H]3[C@@H](OC)C[C@H](O[C@H]4CC[C@@]5(C)C(=CC[C@@H]6[C@@H]5C[C@@H](OC(=O)c5ccccc5)[C@]5(C)[C@@H]([C@H](C)OC(=O)c7ccccc7)CC[C@]65O)C4)O[C@@H]3C)O[C@@H]2C)O[C@H](C)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeCaralluma tuberculata Ref.
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OrganismCaralluma tuberculata
ReferenceAbdel-Sattar,Phytochem.,69,(2008),2180