(Q115971542)

English

3-[(2R,4R,8R,9R,10R,14S,17R,19R)-2,3',4',8,10,14,18,18-octamethyl-5'-oxospiro[5-oxapentacyclo[11.8.0.02,10.04,9.014,19]henicos-1(13)-ene-6,2'-furan]-17-yl]oxy-3-oxopropanoic acid

group of stereoisomers with the chemical formula C₃₄H₄₈O₇

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

568.340003876 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₄H₄₈O₇

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canonical SMILES

O=C1OC2(OC3CC4(C5=C(CCC4(C)C3C(C)C2)C6(C)CCC(OC(=O)CC(=O)O)C(C)(C)C6CC5)C)C(=C1C)C

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isomeric SMILES

CC1=C(C)C2(C[C@@H](C)[C@H]3[C@@H](C[C@@]4(C)C5=C(CC[C@]34C)[C@@]3(C)CC[C@@H](OC(=O)CC(=O)O)C(C)(C)[C@@H]3CC5)O2)OC1=O

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found in taxon

Hexagonia apiaria

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stated in

Chemical Constituents from the Fruiting Bodies of Hexagonia apiaria and Their Anti-inflammatory Activity

Identifiers

InChI

InChI=1S/C34H48O7/c1-18-16-34(20(3)19(2)29(38)41-34)40-23-17-33(8)22-9-10-24-30(4,5)25(39-27(37)15-26(35)36)12-13-31(24,6)21(22)11-14-32(33,7)28(18)23/h18,23-25,28H,9-17H2,1-8H3,(H,35,36)/t18-,23-,24+,25-,28+,31-,32-,33+,34?/m1/s1

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InChIKey

OKJOASLJZNAUJH-XFUXFNBTSA-N

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2 references

3 January 2023

inferred from InChIKey

matched by identifier from

InChIKey

OKJOASLJZNAUJH-XFUXFNBTSA-N

1 reference

(Q115971542)

3-[(2R,4R,8R,9R,10R,14S,17R,19R)-2,3',4',8,10,14,18,18-octamethyl-5'-oxospiro[5-oxapentacyclo[11.8.0.02,10.04,9.014,19]henicos-1(13)-ene-6,2'-furan]-17-yl]oxy-3-oxopropanoic acid

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Identifiers

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