(Q105194865)

English

(1S)-1beta,5abeta,8,8,11abeta,13aalpha-Hexamethyl-3abeta-isopropyl-2,3,3a,4,5,5a,7,7aalpha,8,9,10,11,11a,11balpha,12,13,13a,13bbeta-octadecahydro-1H-cyclopenta[a]chrysen-9beta-ol acetate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

(1,5a,8,8,11a,13a-Hexamethyl-3a-propan-2-yl-1,2,3,4,5,7,7a,9,10,11,11b,12,13,13b-tetradecahydrocyclopenta[a]chrysen-9-yl) acetate

1 reference

based on heuristic

inferred from SMILES

mass

468.396730904 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₂H₅₂O₂

0 references

canonical SMILES

O=C(OC1CCC2(C)C3C(=CCC2C1(C)C)C4(C)CCC5(CCC(C)C5C4(C)CC3)C(C)C)C

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isomeric SMILES

CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H]5[C@@H](C)CC[C@]5(C(C)C)CC[C@]4(C)C3=CC[C@H]2C1(C)C

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found in taxon

Euphorbia stygiana

1 reference

stated in

Pentacyclic triterpenes from Euphorbia stygiana.

Identifiers

InChI

InChI=1S/C32H52O2/c1-20(2)32-17-12-21(3)27(32)31(9)16-13-23-24(30(31,8)18-19-32)10-11-25-28(5,6)26(34-22(4)33)14-15-29(23,25)7/h10,20-21,23,25-27H,11-19H2,1-9H3/t21-,23-,25-,26-,27-,29+,30+,31-,32+/m0/s1

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InChIKey

ONLASPILZCERNQ-AYCGOJHUSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ONLASPILZCERNQ-AYCGOJHUSA-N

1 reference

(Q105194865)

(1S)-1beta,5abeta,8,8,11abeta,13aalpha-Hexamethyl-3abeta-isopropyl-2,3,3a,4,5,5a,7,7aalpha,8,9,10,11,11a,11balpha,12,13,13a,13bbeta-octadecahydro-1H-cyclopenta[a]chrysen-9beta-ol acetate

Statements

Identifiers

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