(Q105234062)

English

(3R,8S,11S,12S,16R)-15-(5,6-dimethylhept-6-en-2-yl)-7,12,16-trimethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-one

group of stereoisomers with the chemical formula C₃₀H₄₈O

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Statements

group of stereoisomers

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4,14-dimethyl-9,19-cycloergostane steroid

1 reference

4,14-dimethyl-9,19-cycloergostane steroid

424.37051615599995 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

chemical formula

C₃₀H₄₈O

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canonical SMILES

O=C1CCC23CC43CCC5(C)C(CCC5(C)C4CCC2C1C)C(C)CCC(C(=C)C)C

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isomeric SMILES

C=C(C)C(C)CCC(C)C1CC[C@@]2(C)[C@@H]3CC[C@H]4C(C)C(=O)CC[C@@]45CC35CC[C@]12C

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Identifiers

InChI=1S/C30H48O/c1-19(2)20(3)8-9-21(4)23-12-14-28(7)26-11-10-24-22(5)25(31)13-15-29(24)18-30(26,29)17-16-27(23,28)6/h20-24,26H,1,8-18H2,2-7H3/t20?,21?,22?,23?,24-,26-,27+,28-,29+,30?/m0/s1

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RCXORQWZHHYMBR-XXMVDYNMSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

RCXORQWZHHYMBR-XXMVDYNMSA-N

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