input word = C00056221

Metabolite InformationStructural formula
Name Triptersinine Z4
Formula C32H37NO12
Mw 627.23157566
CAS RN 2222108-45-2
C_ID C00056221
InChIKey NQLKZYBDJHUVJQ-KJXAQABYSA-N
InChICode InChI=1S/C32H37NO12/c1-17-9-10-23(43-29(38)22-11-13-39-15-22)31(16-40-18(2)34)27(44-28(37)21-8-7-12-33-14-21)25(41-19(3)35)24-26(42-20(4)36)32(17,31)45-30(24,5)6/h7-8,11-15,17,23-27H,9-10,16H2,1-6H3/t17-,23+,24-,25-,26-,27-,31+,32-/m1/s1
SMILES CC(=O)OC[C@@]12[C@@H](OC(=O)c3ccoc3)CC[C@@H](C)[C@]13OC(C)(C)[C@H]([C@@H](OC(C)=O)[C@H]2OC(=O)c1cccnc1)[C@H]3OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeTripterygium wilfordii Ref.
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