input word = C00042087

Metabolite InformationStructural formula
Name 2alpha-Acetoxytaxusin
Formula C30H42O10
Mw 562.27779756
CAS RN 27854-01-9
C_ID C00042087 ,
InChIKey CNWPSHAWQVTMLN-JTVNDORCNA-N
InChICode InChI=1S/C30H42O10/c1-14-22(36-16(3)31)11-12-30(10)25(14)26(38-18(5)33)21-13-23(37-17(4)32)15(2)24(29(21,8)9)27(39-19(6)34)28(30)40-20(7)35/h21-23,25-28H,1,11-13H2,2-10H3/t21-,22-,23-,25-,26+,27+,28-,30+/m0/s1
SMILES C=C1[C@@H](OC(C)=O)CC[C@@]2(C)[C@@H](OC(C)=O)[C@H](OC(C)=O)C3=C(C)[C@@H](OC(C)=O)C[C@@H]([C@@H](OC(C)=O)[C@H]12)C3(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTaxaceaeTaxus chinensis Ref.
PlantaeTaxaceaeTaxus cuspidata Ref.
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