input word = C00045471

Metabolite InformationStructural formula
Name (-)-Vaganine D
Formula C30H48N2O3
Mw 484.36649341
CAS RN 353228-46-3
C_ID C00045471 ,
InChIKey SYWAOYCXRQDRLP-UEXQMDIUNA-N
InChICode InChI=1S/C30H48N2O3/c1-18(2)17-27(34)31-26-14-16-30(6)24-13-15-29(5)22(19(3)32(7)8)11-12-23(29)21(24)9-10-25(30)28(26)35-20(4)33/h11,17,19,21,23-26,28H,9-10,12-16H2,1-8H3,(H,31,34)/t19-,21-,23-,24-,25-,26-,28+,29+,30+/m0/s1
SMILES O=C(N[C@H]1CC[C@]2([C@H]([C@H]1OC(=O)C)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CC=C2[C@H](C)N(C)C)C)C)C=C(C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-Asp Cholesterol
Organism
Kingdom Family Species Reference
PlantaeBuxaceaeSarcococca coriacea Ref.
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