SpectraBase Compound ID | HLEQruDK3pQ |
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InChI | InChI=1S/C46H58N4O9/c1-8-42(54)23-28-24-45(40(52)57-6,36-30(15-19-49(25-28)26-42)29-13-10-11-14-33(29)47-36)32-21-31-34(22-35(32)56-5)48(4)38-44(31)17-20-50-18-12-16-43(9-2,37(44)50)39(59-27(3)51)46(38,55)41(53)58-7/h10-14,16,21-22,28,37-39,47,54-55H,8-9,15,17-20,23-26H2,1-7H3/t28-,37+,38-,39-,42+,43-,44-,45+,46+/m1/s1 |
InChIKey | JXLYSJRDGCGARV-XQKSVPLYSA-N |
Mol Weight | 811.0 g/mol |
Molecular Formula | C46H58N4O9 |
Exact Mass | 810.420379 g/mol |
SpectraBase Spectrum ID | 20sRHzlO8gM |
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Name | VINBLASTINE |
Compound Number | 1 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C46H58N4O9 |
InChI | InChI=1S/C46H58N4O9/c1-8-42(54)23-28-24-45(40(52)57-6,36-30(15-19-49(25-28)26-42)29-13-10-11-14-33(29)47-36)32-21-31-34(22-35(32)56-5)48(4)38-44(31)17-20-50-18-12-16-43(9-2,37(44)50)39(59-27(3)51)46(38,55)41(53)58-7/h10-14,16,21-22,28,37-39,47,54-55H,8-9,15,17-20,23-26H2,1-7H3/t28-,37+,38-,39-,42+,43-,44-,45+,46+/m1/s1 |
InChIKey | JXLYSJRDGCGARV-XQKSVPLYSA-N |
Literature Reference Author | G.E.MARTIN,B.D.HILTON,K.A.BLINOV,A.J.WILLIAMS |
Literature Reference Citation | J.NAT.PROD.,70,1966(2007) |
Literature Reference DOI | 10.1021/np070361t |
Solvent | DMSO-D6 |
Source File Reference | UWMZ31028 |