input word = C00040786

Metabolite InformationStructural formula
Name 1-Hydroxy-2,7,9-trideacetylbaccatin I
(-)-1-Hydroxy-2,7,9-trideacetylbaccatin I
Formula C26H38O11
Mw 526.24141206
CAS RN 157664-02-3
C_ID C00040786 ,
InChIKey FZSTXGZIVKPKQT-QMNCXIARNA-N
InChICode InChI=1S/C26H38O11/c1-11-15(35-12(2)27)9-26(33)22(32)20-24(7,16(30)8-17(36-13(3)28)25(20)10-34-25)21(31)19(37-14(4)29)18(11)23(26,5)6/h15-17,19-22,30-33H,8-10H2,1-7H3/t15-,16-,17-,19+,20-,21?,22-,24+,25+,26+/m0/s1
SMILES CC(=O)O[C@H]1C[C@@]2(O)[C@@H](O)C3[C@@](C)([C@@H](O)C[C@H](OC(C)=O)[C@]34CO4)[C@@H](O)[C@H](OC(C)=O)C(=C1C)C2(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTaxaceaeTaxus yunnanensis Ref.
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