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AGMINOSIDE_B
SpectraBase Compound ID 2KjNt5yWjok
InChI InChI=1S/C83H130O47/c1-14-29-51(30-27-25-23-21-19-17-15-16-18-20-22-24-26-28-31-106-33-58(77(104)105)112-44(7)90)119-80-72(129-79-65(103)70(115-47(10)93)67(113-45(8)91)55(123-79)36-109-41(4)87)64(102)66(52(32-84)120-80)126-82-75(118-50(13)96)74(117-49(12)95)69(57(125-82)38-111-43(6)89)127-83-76(73(116-48(11)94)68(114-46(9)92)56(124-83)37-110-42(5)88)130-81-71(62(100)60(98)54(122-81)35-108-40(3)86)128-78-63(101)61(99)59(97)53(121-78)34-107-39(2)85/h51-76,78-84,97-103H,14-38H2,1-13H3,(H,104,105)/t51-,52+,53+,54+,55+,56+,57+,58-,59+,60+,61-,62-,63+,64-,65+,66+,67+,68+,69+,70+,71+,72+,73-,74-,75+,76+,78-,79-,80+,81-,82-,83-/m1/s1
InChIKey HQHWXYHGCAUTOG-IQEGRPEKSA-N
Mol Weight 1879.9 g/mol
Molecular Formula C83H130O47
Exact Mass 1878.778241 g/mol
Enantiomer InChIKey HQHWXYHGCAUTOG-QNUVARLOSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD3OD
Title Journal or Book Year
The Agminosides: Naturally Acetylated Glycolipids from the New Zealand Marine Sponge Raspailia agminata Journal of Natural Products 2010

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