input word = C00041184

Metabolite InformationStructural formula
Name Taxuspinanane B
(+)-Taxuspinanane B
Formula C33H40O11
Mw 612.25706212
CAS RN 187740-01-8
C_ID C00041184 ,
InChIKey CXSZDWCQWKJJEB-NHIHDXKZNA-N
InChICode InChI=1S/C33H40O11/c1-16-22(37)14-24(41-18(3)34)32(8)26(16)28(42-19(4)35)33(31(6,7)40)15-23(38)17(2)25(33)27(29(32)43-20(5)36)44-30(39)21-12-10-9-11-13-21/h9-13,22,24,26-29,37,40H,1,14-15H2,2-8H3/t22-,24-,26-,27+,28-,29-,32+,33-/m0/s1
SMILES C=C1[C@@H](O)C[C@H](OC(C)=O)[C@@]2(C)[C@@H](OC(C)=O)[C@H](OC(=O)c3ccccc3)C3=C(C)C(=O)C[C@@]3(C(C)(C)O)[C@@H](OC(C)=O)[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTaxaceaeTaxus cuspidata Ref.
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