(Q105001067)

English

(16S)-16-(2-hydroperoxypropan-2-yl)-11,20-dihydroxy-7,7-dimethyl-2,8,17-trioxapentacyclo[12.9.0.03,12.04,9.018,23]tricosa-1(14),3(12),4(9),5,10,18(23),19,21-octaen-13-one

chemical compound

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instance of

type of chemical entity

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subclass of

16-(2-hydroperoxypropan-2-yl)-11,20-dihydroxy-7,7-dimethyl-2,8,17-trioxapentacyclo[12.9.0.0³,¹².0⁴,⁹.0¹⁸,²³]tricosa-1(14),3,5,9,11,18,20,22-octaen-13-one

1 reference

based on heuristic

inferred from SMILES

mass

452.147117728 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₅H₂₄O₈

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canonical SMILES

O=C1C2=C(O)C=C3OC(C=CC3=C2OC=4C=5C=CC(O)=CC5OC(CC14)C(OO)(C)C)(C)C

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isomeric SMILES

CC1(C)C=Cc2c(cc(O)c3c(=O)c4c(oc23)-c2ccc(O)cc2O[C@H](C(C)(C)OO)C4)O1

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found in taxon

Morus alba

1 reference

stated in

Antiviral flavonoids from the root bark of Morus alba L.

Identifiers

InChI

InChI=1S/C25H24O8/c1-24(2)8-7-14-18(32-24)11-16(27)20-21(28)15-10-19(25(3,4)33-29)30-17-9-12(26)5-6-13(17)22(15)31-23(14)20/h5-9,11,19,26-27,29H,10H2,1-4H3/t19-/m0/s1

0 references

InChIKey

FTIZDJNLUATQGK-IBGZPJMESA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

FTIZDJNLUATQGK-IBGZPJMESA-N

(Q105001067)

(16S)-16-(2-hydroperoxypropan-2-yl)-11,20-dihydroxy-7,7-dimethyl-2,8,17-trioxapentacyclo[12.9.0.03,12.04,9.018,23]tricosa-1(14),3(12),4(9),5,10,18(23),19,21-octaen-13-one

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