input word = C00024020

Metabolite InformationStructural formula
Name Paxillarine A
Formula C33H50N2O4
Mw 538.3770581
CAS RN 145022-89-5
C_ID C00024020 ,
InChIKey CEFWIVSCALJZMU-RKYZBSDUNA-N
InChICode InChI=1S/C33H50N2O4/c1-20(34(5)6)29-28(37)19-26-23-13-14-25-30(39-21(2)36)27(35(7)31(38)22-11-9-8-10-12-22)16-18-32(25,3)24(23)15-17-33(26,29)4/h8-12,20,23-30,37H,13-19H2,1-7H3/t20-,23+,24-,25-,26-,27+,28-,29-,30+,32+,33+/m0/s1
SMILES C1[C@H]([C@@H]([C@H]2[C@](C1)([C@@H]1[C@@H](CC2)[C@H]2[C@@](CC1)([C@H]([C@H](C2)O)[C@H](C)N(C)C)C)C)OC(=O)C)N(C(=O)c1ccccc1)C
Start Substs in Alk. Biosynthesis (Prediction) L-Asp
Organism
Kingdom Family Species Reference
PlantaeBuxaceaePachysandra axillaris FRANCH Ref.
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