input word = C00032290

Metabolite InformationStructural formula
Name Tarecilioside B
(+)-Tarecilioside B
Tarecilioside B
Formula C36H62O11
Mw 670.42921282
CAS RN 1064656-41-2
C_ID C00032290 ,
InChIKey PQMDZXOZFXZRLE-HFKLJLLANA-N
InChICode InChI=1S/C36H62O11/c1-18(7-8-23(41)34(6,45)17-38)25-20(40)14-33(5)29-19(39)13-22-31(2,3)24(47-30-28(44)27(43)26(42)21(15-37)46-30)9-10-35(22)16-36(29,35)12-11-32(25,33)4/h18-30,37-45H,7-17H2,1-6H3/t18-,19+,20+,21-,22+,23-,24+,25+,26-,27+,28-,29+,30+,32-,33+,34+,35-,36+/m1/s1
SMILES C[C@H](CC[C@@H](O)C(C)(O)CO)[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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