input word = C00049415

Metabolite InformationStructural formula
Name 2-Deacetyltaxachitriene A
(-)-2-Deacetyltaxachitriene A
Formula C30H42O12
Mw 594.26762681
CAS RN 214769-96-7
C_ID C00049415 ,
InChIKey ARCDGVGZYWJKDA-WMEHUCQENA-N
InChICode InChI=1S/C30H42O12/c1-14-25(39-17(4)32)11-22-24(37)10-21(13-38-16(3)31)23(36)12-26(40-18(5)33)15(2)28(41-19(6)34)29(42-20(7)35)27(14)30(22,8)9/h10,22-26,29,36-37H,11-13H2,1-9H3/b21-10+,28-15-/t22-,23+,24+,25+,26+,29-/m1/s1
SMILES C1(=C2[C@H](/C(=C(/[C@H](C[C@@H](/C(=C/[C@@H]([C@@H](C[C@@H]1OC(=O)C)C2(C)C)O)/COC(=O)C)O)OC(=O)C)\C)/OC(=O)C)OC(=O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTaxaceaeTaxus chinensis Ref.
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OrganismTaxus chinensis
ReferenceBaloglu,J.Nat.Prod.,62,(1999),1448