(Q105245378)

English

(1R,2S,5S,9S,13R)-2-hydroxy-5-(hydroxymethyl)-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecan-6-one

group of stereoisomers with the chemical formula C₂₀H₃₀O₃

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Statements

group of stereoisomers

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kaurane diterpenoid

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kaurane diterpenoid

318.21949481999997 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₀H₃₀O₃

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canonical SMILES

O=C1CCC2(C)C3CCC4C(=C)CC3(C4)C(O)CC2C1(C)CO

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isomeric SMILES

C=C1C[C@]23C[C@H]1CCC2[C@]1(C)CCC(=O)[C@](C)(CO)C1C[C@@H]3O

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Identifiers

InChI=1S/C20H30O3/c1-12-9-20-10-13(12)4-5-14(20)18(2)7-6-16(22)19(3,11-21)15(18)8-17(20)23/h13-15,17,21,23H,1,4-11H2,2-3H3/t13-,14?,15?,17+,18+,19-,20+/m1/s1

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RTSXHDJXXBECPR-RVJFQXQRSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

RTSXHDJXXBECPR-RVJFQXQRSA-N

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