SpectraBase Compound ID | 710EP8pKz9I |
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InChI | InChI=1S/C30H28N6O8S6/c1-33-23(43)29-17(39)27(13-7-3-5-9-15(13)31-19(27)35(29)21(41)25(33,11-37)45-49-47-29)28-14-8-4-6-10-16(14)32-20(28)36-22(42)26(12-38)34(2)24(44)30(36,18(28)40)48-50-46-26/h3-10,17-20,31-32,37-40H,11-12H2,1-2H3/t17-,18-,19+,20+,25+,26+,27+,28?,29+,30+/m0/s1 |
InChIKey | CZHZTVHMGFRKRJ-YWGJFYHJSA-N |
Mol Weight | 792.9 g/mol |
Molecular Formula | C30H28N6O8S6 |
Exact Mass | 792.029289 g/mol |
SpectraBase Spectrum ID | 4PDnWWHzEyM |
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Name | CHETRACIN_C |
Compound Number | 2 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C30H28N6O8S6 |
InChI | InChI=1S/C30H28N6O8S6/c1-33-23(43)29-17(39)27(13-7-3-5-9-15(13)31-19(27)35(29)21(41)25(33,11-37)45-49-47-29)28-14-8-4-6-10-16(14)32-20(28)36-22(42)26(12-38)34(2)24(44)30(36,18(28)40)48-50-46-26/h3-10,17-20,31-32,37-40H,11-12H2,1-2H3/t17-,18-,19+,20+,25+,26+,27+,28?,29+,30+/m0/s1 |
InChIKey | CZHZTVHMGFRKRJ-YWGJFYHJSA-N |
Literature Reference Author | L.LI,D.LI,Y.LUAN,Q.GU,T.ZHU |
Literature Reference Citation | J.NAT.PROD.,75,920(2012) |
Literature Reference DOI | 10.1021/np3000443 |
Molecular Weight | 792.948 g/mol |
Sample ID | 40414 |
Solvent | DMSO-D6 |