(Q105134042)

English

6-[7-(Hydroxymethyl)-7,12,16-trimethyl-6-oxo-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-2-methylhept-2-enoic acid

group of stereoisomers with the chemical formula C₃₀H₄₆O₄

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Statements

group of stereoisomers

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cycloartane triterpenoid

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cycloartane triterpenoid

470.3396099519999 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₀H₄₆O₄

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canonical SMILES

O=C(O)C(=CCCC(C)C1CCC2(C)C3CCC4C(C(=O)CCC54CC35CCC12C)(C)CO)C

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Identifiers

InChI=1S/C30H46O4/c1-19(7-6-8-20(2)25(33)34)21-11-13-28(5)23-10-9-22-26(3,18-31)24(32)12-14-29(22)17-30(23,29)16-15-27(21,28)4/h8,19,21-23,31H,6-7,9-18H2,1-5H3,(H,33,34)

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JRQCOSMCTGXCGO-UHFFFAOYSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

JRQCOSMCTGXCGO-UHFFFAOYSA-N

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