(Q105302171)

English

(23-Methoxy-4,5,9,9,13,19,20-heptamethyl-24-oxahexacyclo[14.6.2.01,18.04,17.05,14.08,13]tetracosan-10-yl) benzoate

group of stereoisomers with the chemical formula C₃₈H₅₆O₄

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Statements

instance of

group of stereoisomers

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subclass of

taraxastane / ursane triterpenoid

1 reference

inferred from

taraxastane / ursane triterpenoid

mass

576.417860272 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₈H₅₆O₄

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canonical SMILES

O=C(OC1CCC2(C)C(CCC3(C)C2CC4OC(OC)C56CCC(C)C(C)C6C4C3(C)CC5)C1(C)C)C=7C=CC=CC7

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Identifiers

InChI

InChI=1S/C38H56O4/c1-23-14-19-38-21-20-37(7)31(30(38)24(23)2)26(41-33(38)40-8)22-28-35(5)17-16-29(42-32(39)25-12-10-9-11-13-25)34(3,4)27(35)15-18-36(28,37)6/h9-13,23-24,26-31,33H,14-22H2,1-8H3

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InChIKey

WCYCUUGSIMSHLH-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

WCYCUUGSIMSHLH-UHFFFAOYSA-N

(Q105302171)

(23-Methoxy-4,5,9,9,13,19,20-heptamethyl-24-oxahexacyclo[14.6.2.01,18.04,17.05,14.08,13]tetracosan-10-yl) benzoate

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Identifiers

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