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14',16',20'-epi-20'-deoxyleurosidine
SpectraBase Compound ID GVmvzvyGD1Q
InChI InChI=1S/C46H58N4O8/c1-8-28-21-29-24-45(41(52)56-6,37-31(15-19-49(25-28)26-29)30-13-10-11-14-34(30)47-37)33-22-32-35(23-36(33)55-5)48(4)39-44(32)17-20-50-18-12-16-43(9-2,38(44)50)40(58-27(3)51)46(39,54)42(53)57-7/h10-14,16,22-23,28-29,38-40,47,54H,8-9,15,17-21,24-26H2,1-7H3/t28-,29+,38+,39-,40-,43-,44-,45+,46+/m1/s1
InChIKey AGKYIOIIEPFTEV-XAYRGYGFSA-N
Mol Weight 795.0 g/mol
Molecular Formula C46H58N4O8
Exact Mass 794.425465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6jcIfsgVhLI
Name 14',16',20'-epi-20'-deoxyleurosidine
Alternate Name(s) 14'-epi-20'-deoxyvinblastine 1H-Indolizino[8,1-cd]carbazole, vincaleukoblastine deriv. 14'-epi-20'-deoxyleurosidine 20'-Deoxyvinblastine 14'-epi-20'-deoxyvincovaline 20'-deoxyvincovaline 20'-deoxyleurosidine 4'(20').beta.-Vincaleukoblastine, 4'-deoxy- 2H-3,7-Methanoazacycloundecino[5,4-b]indole, vincaleukoblastine deriv. 20'-Deoxyvincaleukoblastine 4'-Deoxyleurosidine Vincaleukoblastine, 4'-deoxy-, (4'.alpha.)- Deoxyvincaleukoblastine B 4'-Deoxyvinblastine Isoleurosine Vincaleukoblastine B, deoxy- 4'-Deoxyvincaleukoblastine Deoxyvincaleukoblastine A Vincaleukoblastine, 4'-deoxy- Methyl (3aR,4R,5R,6S,6aR,11bR)-4-[(1Z)-1-butenyl]-4-ethyl-10-[(13S,15R)-17-ethyl-13-(methoxycarbonyl)-1,11-diazatetracyclo[13.3.1.0(4,12).0(5,10)]nonadeca-4(12),5,7,9,16-pentaen-13-yl]-7-formyl-6-hydroxy-5,9-dimethoxy-2,3,3a,4,5,6,6a,7-octahydro-1H-pyrrolo[2,3-d]carbazole-6-carboxylate Vincaleukoblastine A, deoxy-
CAS Registry Number 20072-25-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C46H58N4O8
InChI InChI=1S/C46H58N4O8/c1-8-28-21-29-24-45(41(52)56-6,37-31(15-19-49(25-28)26-29)30-13-10-11-14-34(30)47-37)33-22-32-35(23-36(33)55-5)48(4)39-44(32)17-20-50-18-12-16-43(9-2,38(44)50)40(58-27(3)51)46(39,54)42(53)57-7/h10-14,16,22-23,28-29,38-40,47,54H,8-9,15,17-21,24-26H2,1-7H3/t28-,29+,38+,39-,40-,43-,44-,45+,46+/m1/s1
InChIKey AGKYIOIIEPFTEV-XAYRGYGFSA-N
Literature Reference DOI 10.1021/jo00275a029
Molecular Weight 794.990 g/mol
SMILES [nH]1c2ccccc2c2c1[C@@](c1cc3[C@@]45[C@]([C@]([C@@]([C@]6([C@@]4(N(CC=C6)CC5)[H])CC)(OC(=O)C)[H])(C(=O)OC)O)(N(c3cc1OC)C)[H])(C[C@]1(CN(CC2)C[C@@](C1)(CC)[H])[H])C(=O)OC
SPLASH splash10-000i-5911100200-f980745b095281abe570
Source of Spectrum J-54-3414-6
Wiley ID 1417086