input word = C00045134

Metabolite InformationStructural formula
Name Vincosamide
Formula C26H30N2O8
Mw 498.20021595
CAS RN 23141-27-7
C_ID C00045134 ,
InChIKey LBRPLJCNRZUXLS-ZHDJGCKYNA-N
InChICode InChI=1S/C26H30N2O8/c1-2-12-15-9-18-20-14(13-5-3-4-6-17(13)27-20)7-8-28(18)24(33)16(15)11-34-25(12)36-26-23(32)22(31)21(30)19(10-29)35-26/h2-6,11-12,15,18-19,21-23,25-27,29-32H,1,7-10H2/t12-,15-,18+,19+,21+,22-,23+,25-,26-/m0/s1
SMILES c1ccc2c(c1)c1c([nH]2)[C@@H]2N(CC1)C(=O)C1=CO[C@H]([C@H]([C@@H]1C2)C=C)O[C@H]1[C@H](O)[C@H]([C@@H]([C@H](O1)CO)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeCornaceaeCamptotheca acuminata Ref.
PlantaeHydrangeaceaePileostegia viburnoides var. glabrescens Ref.
PlantaeRubiaceaeAdina racemosa Ref.
PlantaeRubiaceaeNauclea orientalis Ref.
PlantaeRubiaceaeSinoadina racemosa Ref.
PlantaeRubiaceaeUncaria rhynchophylla Ref.
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