(Q104393234)

English

[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl] 1,10,11-trihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate

group of stereoisomers with the chemical formula C₃₆H₅₈O₁₀

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Statements

instance of

group of stereoisomers

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subclass of

oleanane triterpenoid

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inferred from

oleanane triterpenoid

mass

650.402998056 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₆H₅₈O₁₀

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canonical SMILES

O=C(OC1OC(CO)C(O)C(O)C1O)C23CCC(C)(C)C(O)C3C4=CCC5C6(C)CC(O)C(O)C(C)(C)C6CCC5(C)C4(C)CC2

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found in taxon

Moquilea licaniaeflora

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stated in

Triterpenes from Licania licaniaeflora.

Sanguisorba tenuifolia

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stated in

Triterpenoids from the roots of Sanguisorba tenuifolia var. Alba.

Adinandra nitida

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stated in

Triterpene saponins from Eryngium campestre

Sanguisorba tenuifolia var. alba

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stated in

Triterpenoids from the roots of Sanguisorba tenuifolia var. Alba.

Identifiers

InChI

InChI=1S/C36H58O10/c1-31(2)12-14-36(30(44)46-29-26(41)25(40)24(39)20(17-37)45-29)15-13-34(6)18(23(36)28(31)43)8-9-22-33(5)16-19(38)27(42)32(3,4)21(33)10-11-35(22,34)7/h8,19-29,37-43H,9-17H2,1-7H3

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InChIKey

CUOZRGBQTOSWAY-UHFFFAOYSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

CUOZRGBQTOSWAY-UHFFFAOYSA-N

1 reference

(Q104393234)

[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl] 1,10,11-trihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate

Statements

Identifiers

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