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HETEROPHYLLIIN-A

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HETEROPHYLLIIN-A
SpectraBase Compound ID EfTpRgwirVZ
InChI InChI=1S/C34H26O22/c35-12-1-8(2-13(36)21(12)41)30(48)55-29-27(47)34(56-31(49)9-3-14(37)22(42)15(38)4-9)53-18-7-52-32(50)10-5-16(39)23(43)25(45)19(10)20-11(33(51)54-28(18)29)6-17(40)24(44)26(20)46/h1-6,18,27-29,34-47H,7H2/t18-,27-,28-,29-,34+/m1/s1
InChIKey NLDMNSXOCDLTTB-LQZDAVIGSA-N
Mol Weight 786.6 g/mol
Molecular Formula C34H26O22
Exact Mass 786.091572 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KGrStufJ24S
Name HETEROPHYLLIIN-A
Compound Number VII
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H26O22
InChI InChI=1S/C34H26O22/c35-12-1-8(2-13(36)21(12)41)30(48)55-29-27(47)34(56-31(49)9-3-14(37)22(42)15(38)4-9)53-18-7-52-32(50)10-5-16(39)23(43)25(45)19(10)20-11(33(51)54-28(18)29)6-17(40)24(44)26(20)46/h1-6,18,27-29,34-47H,7H2/t18-,27-,28-,29-,34+/m1/s1
InChIKey NLDMNSXOCDLTTB-LQZDAVIGSA-N
Literature Reference Author J.ZHEXIONG,L.XIN
Literature Reference Citation J.CHEM.PHARM.RES.,6,6,1770(2014)
Molecular Weight 786.567 g/mol
Solvent ACETONE-D6:D2O
Source File Reference UWBT13673