(Q105313607)

English

[(2S,3R,6E,10E,14E,18E,22R)-3-acetyloxy-2,22,23-trihydroxy-2,6,10,15,19,23-hexamethyltetracosa-6,10,14,18-tetraenyl] acetate

chemical compound

In more languages

Statements

type of chemical entity

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biogenic acyclic ester

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squalane triterpenoid

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578.418254196 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₄H₅₈O₇

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canonical SMILES

O=C(OCC(O)(C)C(OC(=O)C)CCC(=CCCC(=CCCC=C(C)CCC=C(C)CCC(O)C(O)(C)C)C)C)C

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isomeric SMILES

CC(=O)OC[C@](C)(O)[C@@H](CC/C(C)=C/CC/C(C)=C/CC/C=C(\C)CC/C=C(\C)CC[C@@H](O)C(C)(C)O)OC(C)=O

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Ekebergia capensis

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Antiplasmodial triterpenoids from Ekebergia capensis.

Identifiers

InChI=1S/C34H58O7/c1-25(16-12-18-27(3)20-22-31(37)33(7,8)38)14-10-11-15-26(2)17-13-19-28(4)21-23-32(41-30(6)36)34(9,39)24-40-29(5)35/h14-15,18-19,31-32,37-39H,10-13,16-17,20-24H2,1-9H3/b25-14+,26-15+,27-18+,28-19+/t31-,32-,34+/m1/s1

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WVMDVHDOEYMXEG-JWJOUKKDSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

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