(Q105248800)

English

[(3R,4aS,6aS,6aR,6bS,8aS,9R,10S,12aS,14aS,14bR)-10-hydroxy-2,2,4a,6a,6a,8a,9,14a-octamethyl-1,3,4,5,6,6b,7,8,9,10,11,12,12a,13,14,14b-hexadecahydropicen-3-yl] acetate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

10-hydroxy-2,2,4a,6a,8a,9,12b,14a-octamethyl-hexadecahydropicen-3-yl acetate

1 reference

based on heuristic

inferred from SMILES

mass

486.407295588 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₂H₅₄O₃

0 references

canonical SMILES

O=C(OC1CC2(C)CCC3(C)C4CCC5(C)C(C)C(O)CCC5C4(C)CCC3(C)C2CC1(C)C)C

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isomeric SMILES

CC(=O)O[C@@H]1C[C@]2(C)CC[C@]3(C)[C@H]4CC[C@@]5(C)[C@@H](CC[C@H](O)[C@@H]5C)[C@]4(C)CC[C@@]3(C)[C@@H]2CC1(C)C

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found in taxon

Euphorbia tortilis

1 reference

stated in

Two D:A-friedo-oleanane derivatives from Euphorbia tortilis

Identifiers

InChI

InChI=1S/C32H54O3/c1-20-22(34)10-11-23-29(20,6)13-12-24-30(23,7)15-17-32(9)25-18-27(3,4)26(35-21(2)33)19-28(25,5)14-16-31(24,32)8/h20,22-26,34H,10-19H2,1-9H3/t20-,22-,23+,24-,25+,26+,28-,29+,30-,31+,32-/m0/s1

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InChIKey

SAEHZURVLRNDEH-APJAQGNPSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

SAEHZURVLRNDEH-APJAQGNPSA-N

(Q105248800)

[(3R,4aS,6aS,6aR,6bS,8aS,9R,10S,12aS,14aS,14bR)-10-hydroxy-2,2,4a,6a,6a,8a,9,14a-octamethyl-1,3,4,5,6,6b,7,8,9,10,11,12,12a,13,14,14b-hexadecahydropicen-3-yl] acetate

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Identifiers

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