(Q105130358)

English

1-[(5Z)-5-isopropylhept-5-en-2-yl]-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,5H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-7-one

group of stereoisomers with the chemical formula C₂₉H₄₆O

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Statements

group of stereoisomers

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chemical compound

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410.354866092 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₉H₄₆O

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canonical SMILES

O=C1C=C2CCC3C(CCC4(C)C(CCC34)C(C)CCC(=CC)C(C)C)C2(C)CC1

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isomeric SMILES

C/C=C(/CCC(C)C1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C)C(C)C

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based on heuristic

inferred from InChI

Identifiers

InChI=1S/C29H46O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h7,18-20,24-27H,8-17H2,1-6H3/b21-7-

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JKNOXDGSYQSJQT-YXSASFKJSA-N

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