SpectraBase Compound ID | DKlOIzNz0jL |
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InChI | InChI=1S/C49H78O22/c1-19(15-63-45-41(61)37(57)36(56)31(14-50)69-45)5-6-29-20(2)33-30(68-29)13-24-22-12-26(51)25-11-21(7-9-48(25,3)23(22)8-10-49(24,33)4)67-47-42(62)38(58)43(71-46-40(60)35(55)28(53)17-65-46)32(70-47)18-66-44-39(59)34(54)27(52)16-64-44/h19,21-25,27-28,30-47,50,52-62H,5-18H2,1-4H3/t19-,21+,22-,23+,24+,25-,27+,28+,30+,31-,32-,33+,34+,35-,36-,37+,38-,39-,40+,41-,42-,43-,44+,45-,46-,47-,48?,49?/m1/s1 |
InChIKey | ALMJXWPCHVBUTP-SZBAQTDBSA-N |
Mol Weight | 1019.1 g/mol |
Molecular Formula | C49H78O22 |
Exact Mass | 1018.498474 g/mol |
SpectraBase Spectrum ID | KzC9Bjh6v0K |
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Name | #63;CHINENOSIDE-II;26-O-BETA-D-GLUCOPYRANOSYL-3-BETA,26-DIHYDROXY-(25R)-5-ALPHA-FUROST-6-ON-20(22)-ENE-3-O-[BETA-D-XYLOPYRANOSYL-(1->4)]-[ALPHA-L-ARABINOPYRANO |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C49H78O22 |
InChI | InChI=1S/C49H78O22/c1-19(15-63-45-41(61)37(57)36(56)31(14-50)69-45)5-6-29-20(2)33-30(68-29)13-24-22-12-26(51)25-11-21(7-9-48(25,3)23(22)8-10-49(24,33)4)67-47-42(62)38(58)43(71-46-40(60)35(55)28(53)17-65-46)32(70-47)18-66-44-39(59)34(54)27(52)16-64-44/h19,21-25,27-28,30-47,50,52-62H,5-18H2,1-4H3/t19-,21+,22-,23+,24+,25-,27+,28+,30+,31-,32-,33+,34+,35-,36-,37+,38-,39-,40+,41-,42-,43-,44+,45-,46-,47-,48?,49?/m1/s1 |
InChIKey | ALMJXWPCHVBUTP-SZBAQTDBSA-N |
Literature Reference Author | P.K.AGRAWAL |
Literature Reference Citation | STEROIDS,70,715(2005) |
Literature Reference DOI | 10.1016/j.steroids.2005.04.001 |
Molecular Weight | 1019.145 g/mol |
Sample ID | 968808 |
Solvent | C5D5N |