input word = C00028969

Metabolite InformationStructural formula
Name Sarcovagine B
Formula C30H50N2O4
Mw 502.3770581
CAS RN 192385-46-9
C_ID C00028969 ,
InChIKey QDWARQARJPJBNM-JGKQRATNNA-N
InChICode InChI=1S/C30H50N2O4/c1-9-17(2)28(35)31-26-25(34)16-30(6)23-14-15-29(5)21(18(3)32(7)8)12-13-22(29)20(23)10-11-24(30)27(26)36-19(4)33/h9,18,20-27,34H,10-16H2,1-8H3,(H,31,35)/b17-9+/t18-,20-,21+,22-,23-,24-,25+,26-,27+,29+,30+/m0/s1
SMILES [C@@H]1([C@@H]([C@@H]([C@H]2[C@](C1)([C@@H]1[C@@H](CC2)[C@H]2[C@](CC1)([C@H](CC2)[C@H](C)N(C)C)C)C)OC(=O)C)NC(=O)/C(=C/C)/C)O
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Cholesterol
Organism
Kingdom Family Species Reference
PlantaeBuxaceaeSarcococca vagans Stapt. Ref.
--Sacococca vagans Ref.
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