SpectraBase Compound ID | 7qVotSUSt7a |
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InChI | InChI=1S/C33H42O12/c1-15(2)24(36)44-27-29(4,5)22(21(25(37)40-8)42-16(3)34)31(7)18-9-11-30(6)19(33(18)28(45-33)32(27,39)26(31)38)13-20(35)43-23(30)17-10-12-41-14-17/h10,12,14-15,18-19,21-23,27-28,39H,9,11,13H2,1-8H3/t18-,19-,21?,22+,23+,27+,28-,30-,31-,32+,33-/m1/s1 |
InChIKey | NBEGFUHGXDAIPD-YYMNTRRUSA-N |
Mol Weight | 630.7 g/mol |
Molecular Formula | C33H42O12 |
Exact Mass | 630.267627 g/mol |
SpectraBase Spectrum ID | 4L9LimiUn1l |
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Name | HUMILINOLIDE-B |
Compound Number | 2 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C33H42O12 |
InChI | InChI=1S/C33H42O12/c1-15(2)24(36)44-27-29(4,5)22(21(25(37)40-8)42-16(3)34)31(7)18-9-11-30(6)19(33(18)28(45-33)32(27,39)26(31)38)13-20(35)43-23(30)17-10-12-41-14-17/h10,12,14-15,18-19,21-23,27-28,39H,9,11,13H2,1-8H3/t18-,19-,21?,22+,23+,27+,28-,30-,31-,32+,33-/m1/s1 |
InChIKey | NBEGFUHGXDAIPD-YYMNTRRUSA-N |
Literature Reference Author | R.SEGURA-CORREA,R.MATA,A.L.ANAYA,B.HERNANDEZ-BAUTISTA,R.VILL ENA,M.SORIANO-GARCIA |
Literature Reference Citation | J.NAT.PROD.,56,1567(1993) |
Literature Reference DOI | 10.1021/np50099a016 |
Molecular Weight | 630.689 g/mol |
Solvent | CDCl3 |
Source File Reference | UWCS17808 |