(Q105217331)

English

(1S,2S,3R,5S,6S,7R,14R,15S,18R,21S,22R)-5,7,18-trihydroxy-1,14,21-trimethyl-25-methylidene-4,20,23-trioxaheptacyclo[20.3.1.12,5.03,18.03,21.06,15.09,14]heptacosa-8,10-diene-13,19,24,27-tetrone

chemical compound

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instance of

type of chemical entity

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subclass of

chemical compound

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mass

526.18389716 dalton

1 reference

1 reference

C₂₈H₃₀O₁₀

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canonical SMILES

O=C1OC2CC(C1=C)(C)C3C(=O)C4(O)OC35C(O)(C(=O)OC25C)CCC6C4C(O)C=C7C=CCC(=O)C76C

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isomeric SMILES

C=C1C(=O)O[C@@H]2C[C@@]1(C)[C@@H]1C(=O)[C@@]3(O)O[C@]14[C@@]2(C)OC(=O)[C@@]4(O)CC[C@H]1[C@H]3[C@H](O)C=C2C=CCC(=O)[C@@]21C

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found in taxon

Solanaceae

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stated in

Physalins with anti-inflammatory activity are present in Physalis alkekengi var. franchetii and can function as Michael reaction acceptors

Identifiers

InChI

InChI=1S/C28H30O10/c1-12-21(32)36-17-11-23(12,2)19-20(31)27(35)18-14(24(3)13(10-15(18)29)6-5-7-16(24)30)8-9-26(34)22(33)37-25(17,4)28(19,26)38-27/h5-6,10,14-15,17-19,29,34-35H,1,7-9,11H2,2-4H3/t14-,15+,17+,18-,19-,23+,24-,25-,26-,27-,28-/m0/s1

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InChIKey

QACVUYYDSXFEJW-RKWIMMEGSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

QACVUYYDSXFEJW-RKWIMMEGSA-N

1 reference

(Q105217331)

(1S,2S,3R,5S,6S,7R,14R,15S,18R,21S,22R)-5,7,18-trihydroxy-1,14,21-trimethyl-25-methylidene-4,20,23-trioxaheptacyclo[20.3.1.12,5.03,18.03,21.06,15.09,14]heptacosa-8,10-diene-13,19,24,27-tetrone

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Identifiers

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