Name: Vobtusine
CAS#: 19772-79-3
Chemical Formula: C43H50N4O6
Exact Mass: 718.373
Molecular Weight: 718.89
Elemental Analysis: C, 71.84; H, 7.01; N, 7.79; O, 13.35
Description: Vobtusine is an alkaloid that has been found in V. africana leaves.
IUPAC/Chemical Name: (2S,2aS,3′aR,4′aR,5aR,12bR,12′bR,12′cR,15aR,15′aS,17′aS)-2′,3′,4,4′a,5,6,8,12′c,13,13′,14,14′,17′,17′a-tetradecahydro-12′c-hydroxy-9′-methoxy-spiro[1H,15aH-furo[2′,3′:7,8]indolizino[8,1-cd]carbazole-2(2aH),6′(7′H)-[4H,5H,15aH,16H]furo[2′,3′:7,8]indolizino[8,1-cd]pyrido[1,2,3-lm]carbazole]-7-carboxylic acid, methyl ester
InChi Key: IIMPGJMHQMBXKL-OPDPKHDKSA-N
InChi Code: InChI=1S/C43H50N4O6/c1-50-30-9-5-7-28-32(30)47-24-38(20-25-21-39-13-18-52-31(39)10-15-45-17-12-42(28,36(39)45)43(25,47)49)23-46-16-11-41-27-6-3-4-8-29(27)44-33(41)26(34(48)51-2)22-40(35(41)46)14-19-53-37(38)40/h3-9,25,31,35-37,44,49H,10-24H2,1-2H3/t25-,31+,35+,36+,37+,38+,39-,40+,41+,42-,43-/m1/s1
SMILES Code: COC1=C(N2[C@]3(O)[C@@]45[C@](N6CC5)([H])[C@]([C@]7([H])CC6)(CCO7)C[C@@]3([H])C[C@]8(CN(CC9)[C@@]([C@@]9(C%10=CC=CC=C%10N%11)C%11=C(C(OC)=O)C%12)([H])[C@]%13%12[C@@]8([H])OCC%13)C2)C4=CC=C1
Appearance: Solid powder
關(guān)鍵字： 19772-79-3;Vobtusine;
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