input word = C00032289

Metabolite InformationStructural formula
Name Tarecilioside A
(+)-Tarecilioside A
Formula C36H62O10
Mw 654.4342982
CAS RN 1064656-38-7
C_ID C00032289 ,
InChIKey HYFTVFLOUMYBDG-XNPHTDMSNA-N
InChICode InChI=1S/C36H62O10/c1-18(8-9-23(40)32(4,5)44)25-20(39)15-34(7)29-19(38)14-22-31(2,3)24(46-30-28(43)27(42)26(41)21(16-37)45-30)10-11-35(22)17-36(29,35)13-12-33(25,34)6/h18-30,37-44H,8-17H2,1-7H3/t18-,19+,20+,21-,22+,23-,24+,25+,26-,27+,28-,29+,30+,33-,34+,35-,36+/m1/s1
SMILES C[C@H](CC[C@@H](O)C(C)(C)O)[C@H]1[C@@H](O)C[C@@]2(C)[C@@H]3[C@@H](O)C[C@H]4C(C)(C)[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@@]45C[C@@]35CC[C@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeTarenna gracilipes (HAY.) OHWI Ref.
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