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Isovobtusine

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Isovobtusine
SpectraBase Compound ID IP3YKsK4RDv
InChI 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
InChIKey IIMPGJMHQMBXKL-UHFFFAOYSA-N
Mol Weight 718.9 g/mol
Molecular Formula C43H50N4O6
Exact Mass 718.373035 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2SWrEZ2a5aI
Name 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], vobtusine deriv.
CAS Registry Number 59829-32-2
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C43H50N4O6
InChI 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
InChIKey IIMPGJMHQMBXKL-UHFFFAOYSA-N
Molecular Weight 718.895 g/mol
SMILES OC12N3c4c(cccc4[C@@]11CCN4CCC5OCCC5(CC2CC2(CN5CCC67c8ccccc8NC7=C(CC7(C2OCC7)C56)C(=O)OC)C3)C14)OC
SPLASH splash10-0f7c-0902033200-ef685905f7d2bffb7bbc
Source of Spectrum H-60-2849-0
Synonyms Spiro[1H,15aH-furo[2',3':7,8]indolizino[8,1-cd]carbazole-2(2aH),8'(9'H)-[1H,6H,7H,17aH]furo[2',3':7,8]indolizino[8,1-cd]pyrido[1,2,3-lm]carbazole]-7-carboxylic acid, 2',2'a,4,4',5,5',6,6'a,8,13,14,14'c,15',16'-tetradecahydro-6'a-hydroxy-11'-methoxy-, methyl ester Spiro[1H,15aH-furo[2',3':7,8]indolizino[8,1-cd]carbazole-2(2aH),8'(9'H)-[1H,6H,7H,17aH]furo[2',3':7,8]indolizino[8,1-cd]pyrido[1,2,3-lm]carbazole]-7-carboxylic acid, 2',2'a,4,4',5,5',6,6'a,8,13,14,14'c,15',16'-tetradecahydro-14'c-hydroxy-11'-methoxy-, met yl ester, [2'aS-[2'a.alpha.,5'aS*,6'a.beta.,8'.alpha.(2aS*,5aS*,12bS*,15aS*),14'bS*,14c.alpha.,17'a.beta.]]- Vobtusin Vobtusine Spiro[1H,15aH-furo[2',3':7,8]indolizino[8,1-cd]carbazole-2(2aH),8'(9'H)-[1H,6H,7H,17aH]furo[2',3':7,8]indolizino[8,1-cd]pyrido[1,2,3-lm]carbazole]-7-carboxylic acid, 2',2'a,4,4',5,5',6,6'a,8,13,14,14'c,15',16'-tetradecahydro-6'a-hydroxy-11'-methoxy-, meth l ester
Wiley ID 1415587