(Q105116451)

English

[9,14-Diacetyloxy-15-(4-acetyloxy-5,6-dihydroxy-6-methylheptan-2-yl)-7,7,12,16-tetramethyl-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl] acetate

group of stereoisomers with the chemical formula C₃₈H₆₀O₁₀

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Statements

instance of

group of stereoisomers

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subclass of

cycloartane triterpenoid

1 reference

inferred from

cycloartane triterpenoid

mass

676.41864812 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₈H₆₀O₁₀

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canonical SMILES

O=C(OC(CC(C)C1C(OC(=O)C)CC2(C)C3CC(OC(=O)C)C4C(C)(C)C(OC(=O)C)CCC54CC35CCC12C)C(O)C(O)(C)C)C

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found in taxon

Astragalus orbiculatus

1 reference

stated in

Triterpene glycosides from Astragalus and their genins. LXXV. Sterols and triterpenoids from Astragalus orbiculatus

Identifiers

InChI

InChI=1S/C38H60O10/c1-20(16-26(46-22(3)40)32(43)34(8,9)44)30-27(47-23(4)41)18-36(11)28-17-25(45-21(2)39)31-33(6,7)29(48-24(5)42)12-13-38(31)19-37(28,38)15-14-35(30,36)10/h20,25-32,43-44H,12-19H2,1-11H3

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InChIKey

INVKKQHVQYJZSI-UHFFFAOYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

INVKKQHVQYJZSI-UHFFFAOYSA-N

(Q105116451)

[9,14-Diacetyloxy-15-(4-acetyloxy-5,6-dihydroxy-6-methylheptan-2-yl)-7,7,12,16-tetramethyl-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl] acetate

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Identifiers

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