input word = C00035762

Metabolite InformationStructural formula
Name Tenacissoside H
(-)-Tenacissoside H
Formula C42H66O14
Mw 794.44525682
CAS RN 191729-45-0
C_ID C00035762 ,
InChIKey HRSFCYYMBMDMOU-SRPOEDKPNA-N
InChICode InChI=1S/C42H66O14/c1-11-20(2)37(47)54-34-35-39(7)15-13-26(53-29-19-28(48-9)32(23(5)50-29)55-38-31(46)33(49-10)30(45)22(4)51-38)18-25(39)12-16-41(35)42(56-41)17-14-27(21(3)43)40(42,8)36(34)52-24(6)44/h20,22-23,25-36,38,45-46H,11-19H2,1-10H3/t20-,22+,23+,25-,26-,27-,28+,29-,30+,31+,32+,33+,34-,35+,36+,38-,39-,40-,41-,42+/m0/s1
SMILES CCC(C)C(=O)O[C@@H]1[C@@H](OC(C)=O)[C@]2(C)[C@H](C(C)=O)CC[C@@]23O[C@]32CC[C@H]3C[C@@H](O[C@H]4C[C@@H](OC)[C@H](O[C@@H]5O[C@H](C)[C@@H](O)[C@@H](OC)[C@H]5O)[C@@H](C)O4)CC[C@]3(C)[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeMarsdenia tenacissima Ref.
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