(Q105024214)

English

(6aR,6aS,6bR,8aR,12aR,14aR)-3-hydroxy-4,6a,6b,8a,14a-pentamethyl-11-methylidene-7,8,9,10,12,12a,13,14-octahydro-6aH-picene-2,6-dione

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

3-hydroxy-4,6a,6b,8a,14a-pentamethyl-11-methylidene-7,8,9,10,12,12a,13,14-octahydro-6aH-picene-2,6-dione

1 reference

based on heuristic

inferred from SMILES

mass

420.266445012 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₈H₃₆O₃

0 references

canonical SMILES

O=C1C=C2C(=CC(=O)C3C2(C)CCC4(C)C5CC(=C)CCC5(C)CCC34C)C(=C1O)C

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isomeric SMILES

C=C1CC[C@]2(C)CC[C@]3(C)[C@H]4C(=O)C=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1

0 references

found in taxon

Kothala himbutu

1 reference

stated in

Biogenetically important quinonemethides and other triterpenoid constituents of Salacia reticulata

Identifiers

InChI

InChI=1S/C28H36O3/c1-16-7-8-25(3)9-11-28(6)24-21(30)14-18-17(2)23(31)20(29)15-19(18)26(24,4)10-12-27(28,5)22(25)13-16/h14-15,22,24,31H,1,7-13H2,2-6H3/t22-,24+,25-,26+,27+,28-/m1/s1

0 references

InChIKey

GYXGBILFHHDBLR-XDRIJKKTSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

GYXGBILFHHDBLR-XDRIJKKTSA-N

(Q105024214)

(6aR,6aS,6bR,8aR,12aR,14aR)-3-hydroxy-4,6a,6b,8a,14a-pentamethyl-11-methylidene-7,8,9,10,12,12a,13,14-octahydro-6aH-picene-2,6-dione

Statements

Identifiers

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