10H,20H-5,9:15,19-Dimethenodibenzo[a,i]cyclohexadecene-10,20-dione, 1,11-bis(2,4-dimethoxyphenyl)-1,2,4a,10a,11,12,14a,20a-octahydro-8,18-dihydroxy-6,16-dimethoxy-3,13-dimethyl-, [1R-(1R*,4aS*,10aS*,11R*,14aS*,20aS*)]-

SpectraBase Compound ID	2YzUaIXxx9d
InChI	InChI=1S/C46H48O10/c1-23-13-31(27-11-9-25(51-3)17-39(27)53-5)43-33(15-23)29-19-35(37(47)21-41(29)55-7)46(50)44-32(28-12-10-26(52-4)18-40(28)54-6)14-24(2)16-34(44)30-20-36(45(43)49)38(48)22-42(30)56-8/h9-12,15-22,31-34,43-44,47-48H,13-14H2,1-8H3/t31-,32-,33+,34+,43-,44-/m0/s1
InChIKey	OJHDJNXLZVFZBQ-ZQDHXSLNSA-N Google Search
Mol Weight	760.9 g/mol
Molecular Formula	C46H48O10
Exact Mass	760.324748 g/mol

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SpectraBase Spectrum ID	LwhQQc2Q2vb
Name	10H,20H-5,9:15,19-Dimethenodibenzo[a,i]cyclohexadecene-10,20-dione, 1,11-bis(2,4-dimethoxyphenyl)-1,2,4a,10a,11,12,14a,20a-octahydro-8,18-dihydroxy-6,16-dimethoxy-3,13-dimethyl-, [1R-(1R,4aS,10aS,11R,14aS,20aS)]-
Alternate Name(s)	Hexamethylbrosimeone A
CAS Registry Number	119280-50-1
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C46H48O10
InChI	InChI=1S/C46H48O10/c1-23-13-31(27-11-9-25(51-3)17-39(27)53-5)43-33(15-23)29-19-35(37(47)21-41(29)55-7)46(50)44-32(28-12-10-26(52-4)18-40(28)54-6)14-24(2)16-34(44)30-20-36(45(43)49)38(48)22-42(30)56-8/h9-12,15-22,31-34,43-44,47-48H,13-14H2,1-8H3/t31-,32-,33+,34+,43-,44-/m0/s1
InChIKey	OJHDJNXLZVFZBQ-ZQDHXSLNSA-N
Molecular Weight	760.880 g/mol
SMILES	Oc1c2cc([C@@]3([C@@](C(c4c(cc(c([C@]5(C=C(C[C@]([C@@]5(C2=O)[H])(c2c(cc(cc2)OC)OC)[H])C)[H])c4)OC)O)=O)([C@@](CC(=C3)C)(c2c(cc(cc2)OC)OC)[H])[H])[H])c(c1)OC
SPLASH	splash10-03dl-0321060900-6485807698b3de66f4d9
Source of Spectrum	F-44-6698-1
Wiley ID	1416516