input word = C00041191

Metabolite InformationStructural formula
Name Taxuspine H
Formula C37H49NO9
Mw 651.34073217
CAS RN 164991-81-5
C_ID C00041191 ,
InChIKey MLDJHRMLCGGPCX-WPJLWNDVNA-N
InChICode InChI=1S/C37H49NO9/c1-20-28(42)18-26-31(44-22(3)39)37-21(2)29(47-30(43)19-27(38(9)10)25-14-12-11-13-15-25)16-17-35(37,8)32(45-23(4)40)33(46-24(5)41)36(20,37)34(26,6)7/h11-15,20,26-27,29,31-33H,2,16-19H2,1,3-10H3/t20-,26+,27+,29+,31-,32+,33+,35+,36-,37-/m1/s1
SMILES C=C1[C@@H](OC(=O)CC(c2ccccc2)N(C)C)CC[C@@]2(C)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@]34C(C)C(=O)CC([C@@H](OC(C)=O)[C@]123)C4(C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Asp L-His
Organism
Kingdom Family Species Reference
PlantaeTaxaceaeTaxus cuspidata Ref.
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