(Q105275727)

English

(10R,14S,17S)-17-[(2S)-4-(3,3-dimethyloxiran-2-yl)-4-hydroxybutan-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol

group of stereoisomers with the chemical formula C₃₀H₅₀O₃

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Statements

instance of

group of stereoisomers

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subclass of

lanostane triterpenoid

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inferred from

lanostane triterpenoid

mass

458.37599545999996 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₃₀H₅₀O₃

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canonical SMILES

OC(CC(C)C1CCC2(C3=CCC4C(C)(C)C(O)CCC4(C)C3CCC12C)C)C5OC5(C)C

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isomeric SMILES

C[C@@H](CC(O)C1OC1(C)C)[C@@H]1CC[C@]2(C)C3=CCC4C(C)(C)C(O)CC[C@]4(C)C3CCC12C

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Identifiers

InChI

InChI=1S/C30H50O3/c1-18(17-22(31)25-27(4,5)33-25)19-11-15-30(8)21-9-10-23-26(2,3)24(32)13-14-28(23,6)20(21)12-16-29(19,30)7/h9,18-20,22-25,31-32H,10-17H2,1-8H3/t18-,19-,20?,22?,23?,24?,25?,28+,29?,30+/m0/s1

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InChIKey

UMTABACRBSGXGK-MCHKJTSXSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

UMTABACRBSGXGK-MCHKJTSXSA-N

1 reference

(Q105275727)

(10R,14S,17S)-17-[(2S)-4-(3,3-dimethyloxiran-2-yl)-4-hydroxybutan-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol

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