(Q110196063)

English

3-[12-(2-Hydroxypropan-2-yl)-4,8-dimethyl-5-[1-(5-methyl-6-oxo-2,3-dihydropyran-2-yl)ethyl]-13-tetracyclo[7.5.0.01,13.04,8]tetradecanyl]propanoic acid

group of stereoisomers with the chemical formula C₃₀H₄₆O₅

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

486.334524572 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₀H₄₆O₅

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canonical SMILES

O=C1OC(CC=C1C)C(C)C2CCC3(C)C4CCC(C(O)(C)C)C5(CCC(=O)O)CC45CCC23C

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found in taxon

Schisandra sphenanthera

1 reference

stated in

Schinalactone A, a new cytotoxic triterpenoid from Schisandra sphenanthera

Identifiers

InChI

InChI=1S/C30H46O5/c1-18-7-8-21(35-25(18)33)19(2)20-11-13-28(6)23-10-9-22(26(3,4)34)29(14-12-24(31)32)17-30(23,29)16-15-27(20,28)5/h7,19-23,34H,8-17H2,1-6H3,(H,31,32)

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InChIKey

JBKSSJHZKJPTMI-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

JBKSSJHZKJPTMI-UHFFFAOYSA-N

(Q110196063)

3-[12-(2-Hydroxypropan-2-yl)-4,8-dimethyl-5-[1-(5-methyl-6-oxo-2,3-dihydropyran-2-yl)ethyl]-13-tetracyclo[7.5.0.01,13.04,8]tetradecanyl]propanoic acid

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Identifiers

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