(Q105302460)

English

methyl (1R,4S,5R,9S,10S,13R,15S)-5,9-dimethyl-15-(3-methylbut-2-enoyloxy)-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate

chemical compound

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instance of

type of chemical entity

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subclass of

Methyl 5,9-dimethyl-15-(3-methylbut-2-enoyloxy)-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate

1 reference

based on heuristic

inferred from SMILES

mass

414.277009696 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₆H₃₈O₄

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canonical SMILES

O=C(OC1C(=C)C2CCC3C4(C)CCCC(C(=O)OC)(C)C4CCC13C2)C=C(C)C

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isomeric SMILES

C=C1[C@H](OC(=O)C=C(C)C)[C@@]23CC[C@H]4[C@@](C)(CCC[C@@]4(C)C(=O)OC)[C@@H]2CC[C@@H]1C3

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found in taxon

Wedelia grandiflora

1 reference

stated in

Neuen kaurensaure-derivate aus Wedelia-arten

Identifiers

InChI

InChI=1S/C26H38O4/c1-16(2)14-21(27)30-22-17(3)18-8-9-20-24(4)11-7-12-25(5,23(28)29-6)19(24)10-13-26(20,22)15-18/h14,18-20,22H,3,7-13,15H2,1-2,4-6H3/t18-,19+,20+,22+,24-,25-,26-/m1/s1

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InChIKey

WDKAHRJFGRACDV-BYCYOMRWSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

WDKAHRJFGRACDV-BYCYOMRWSA-N

(Q105302460)

methyl (1R,4S,5R,9S,10S,13R,15S)-5,9-dimethyl-15-(3-methylbut-2-enoyloxy)-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate

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