input word = C00032294

Metabolite InformationStructural formula
Name Tarecilioside F
(+)-Tarecilioside F
Formula C42H70O15
Mw 814.47147157
CAS RN 1064656-61-6
C_ID C00032294 ,
InChIKey DFDNICKFFXMJLY-YNBQFJOINA-N
InChICode InChI=1S/C42H70O15/c1-19(8-9-25(47)38(4,5)57-36-33(53)31(51)29(49)23(17-44)55-36)27-21(46)15-40(7)34-20(45)14-24-37(2,3)26(56-35-32(52)30(50)28(48)22(16-43)54-35)10-11-41(24)18-42(34,41)13-12-39(27,40)6/h19-24,26-36,43-46,48-53H,8-18H2,1-7H3/t19-,20+,21+,22-,23-,24+,26+,27+,28-,29-,30+,31+,32-,33-,34+,35+,36+,39-,40+,41-,42+/m1/s1
SMILES C1[C@@H](C([C@H]2[C@]3(C1)[C@]1([C@@H]([C@H](C2)O)[C@]2([C@@](CC1)(C)[C@H]([C@H](C2)O)[C@@H](CCC(=O)C(C)(O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)C)C)C)C3)(C)C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeTarenna gracilipes (HAY.) OHWI Ref.
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