(Q105124668)

English

[3,4,5-tris(acetyloxy)-6-{[1-(5-ethyl-6-methylheptan-2-yl)-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-7-yl]oxy}oxan-2-yl]methyl hexadecanoate

group of stereoisomers with the chemical formula C₅₇H₉₆O₁₀

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Statements

instance of

group of stereoisomers

0 references

subclass of

stigmastan-type steroid

1 reference

inferred from

stigmastan-type steroid

mass

940.7003492720003 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₅₇H₉₆O₁₀

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canonical SMILES

O=C(OC1C(OC2CC3=CCC4C(CCC5(C)C(CCC45)C(C)CCC(CC)C(C)C)C3(C)CC2)OC(COC(=O)CCCCCCCCCCCCCCC)C(OC(=O)C)C1OC(=O)C)C

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Identifiers

InChI

InChI=1S/C57H96O10/c1-11-13-14-15-16-17-18-19-20-21-22-23-24-25-51(61)62-37-50-52(63-40(6)58)53(64-41(7)59)54(65-42(8)60)55(67-50)66-45-32-34-56(9)44(36-45)28-29-46-48-31-30-47(57(48,10)35-33-49(46)56)39(5)26-27-43(12-2)38(3)4/h28,38-39,43,45-50,52-55H,11-27,29-37H2,1-10H3

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InChIKey

JBZURISFBWQCNL-UHFFFAOYSA-N

0 references

PubChem CID

14520956

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

JBZURISFBWQCNL-UHFFFAOYSA-N

(Q105124668)

[3,4,5-tris(acetyloxy)-6-{[1-(5-ethyl-6-methylheptan-2-yl)-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-7-yl]oxy}oxan-2-yl]methyl hexadecanoate

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Identifiers

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