input word = C00056222

Metabolite InformationStructural formula
Name Triptersinine Z5
Formula C32H37NO12
Mw 627.23157566
CAS RN 2222108-46-3
C_ID C00056222
InChIKey VMSXLCDOXFYVDV-KJXAQABYSA-N
InChICode InChI=1S/C32H37NO12/c1-17-11-12-23(41-19(3)35)31(16-40-18(2)34)27(44-28(37)21-9-7-13-33-15-21)25(42-20(4)36)24-26(32(17,31)45-30(24,5)6)43-29(38)22-10-8-14-39-22/h7-10,13-15,17,23-27H,11-12,16H2,1-6H3/t17-,23+,24-,25-,26-,27-,31+,32-/m1/s1
SMILES CC(=O)OC[C@@]12[C@@H](OC(C)=O)CC[C@@H](C)[C@]13OC(C)(C)[C@H]([C@@H](OC(C)=O)[C@H]2OC(=O)c1cccnc1)[C@H]3OC(=O)c1ccco1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeTripterygium wilfordii Ref.
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OrganismTripterygium wilfordii
ReferenceLv, H. et al., Fitoterapia, 137, (2019), 104190.