input word = C00049536

Metabolite InformationStructural formula
Name Taxuspinanane D
Formula C31H38O11
Mw 586.24141206
CAS RN 198631-39-9
C_ID C00049536 ,
InChIKey GERGUKHEZFJMEB-NYWWDATNNA-N
InChICode InChI=1S/C31H38O11/c1-15-19(34)13-31(38)26(41-27(37)18-10-8-7-9-11-18)24-29(6,20(35)12-21-30(24,14-39-21)42-17(3)33)25(36)23(40-16(2)32)22(15)28(31,4)5/h7-11,20-21,23-26,35-36,38H,12-14H2,1-6H3/t20-,21+,23+,24-,25-,26-,29+,30-,31+/m0/s1
SMILES C1[C@@]2(C(C(=C(C1=O)C)[C@H]([C@@H]([C@]1([C@H]([C@@H]2OC(=O)c2ccccc2)[C@]2([C@@H](C[C@@H]1O)OC2)OC(=O)C)C)O)OC(=O)C)(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTaxaceaeTaxus cuspidata Ref.
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