(Q104886532)

English

(2r,6s)-6-[(3s,5r,10s,12s,13r,14r,17r)-12-Acetoxy-3-hydroxy-4,4,10,13,14-pentamethyl-7,11,15-trioxo-1,2,3,5,6,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxo-heptanoic acid

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

6-[(10S,13R,14R)-12-acetyloxy-3-hydroxy-4,4,10,13,14-pentamethyl-7,11,15-trioxo-1,2,3,5,6,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid

1 reference

1 reference

572.298532988 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2R,6R)-6-[(3S,5S,10S,12S,13R,14S,17R)-12-acetyloxy-3-hydroxy-4,4,10,13,14-pentamethyl-7,11,15-trioxo-1,2,3,5,6,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(2R,6R)-6-[(3S,5R,10S,12S,13R,14R,17R)-12-acetyloxy-3-hydroxy-4,4,10,13,14-pentamethyl-7,11,15-trioxo-1,2,3,5,6,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₃₂H₄₄O₉

0 references

canonical SMILES

O=C(OC1C(=O)C2=C(C(=O)CC3C2(C)CCC(O)C3(C)C)C4(C(=O)CC(C(C)CC(=O)CC(C(=O)O)C)C14C)C)C

0 references

isomeric SMILES

CC(=O)O[C@@H]1C(=O)C2=C(C(=O)C[C@H]3C(C)(C)[C@@H](O)CC[C@]23C)[C@]2(C)C(=O)C[C@H]([C@@H](C)CC(=O)C[C@@H](C)C(=O)O)[C@@]12C

0 references

found in taxon

Ganoderma lucidum

11 references

stated in

Ganoderic acid D, E, F, and H and lucidenic acid D, E, and F, new triterpenoids from Ganoderma lucidum.

stated in

Anti-HIV-1 and anti-HIV-1-protease substances from Ganoderma lucidum

stated in

Changes of the triterpenoid patterns during formation of the fruit body in Ganoderma lucidum

stated in

Comparative study on the strain-specific triterpenoid components of Ganoderma lucidum

stated in

Constituents of the fungus Ganoderma lucidum (Fr.) Karst. II Structures of ganoderic acids F, G, and H, lucidenic acids D2 and E2, and related compounds.

stated in

Triterpenoids from the fungus Ganoderma lucidum

stated in

Structure-activity relationships of ganoderma acids from Ganoderma lucidum as aldose reductase inhibitors

stated in

Analysis of triterpenoids in ganoderma lucidum using liquid chromatography coupled with electrospray ionization mass spectrometry

stated in

Constituents of the fungus Ganoderma lucidum (Fr.) Karst. II Structures of ganoderic acids F, G, and H, lucidenic acids D2 and E2, and related compounds.

stated in

Constituents of the fungus Ganoderma lucidum (Fr.) Karst. I Structures of ganoderic acids C2, E, I, and K, lucidenic acid F and related compounds.

stated in

Antinociceptive components of Ganoderma lucidum

Identifiers

InChI

InChI=1S/C32H44O9/c1-15(11-18(34)12-16(2)28(39)40)19-13-23(37)32(8)24-20(35)14-21-29(4,5)22(36)9-10-30(21,6)25(24)26(38)27(31(19,32)7)41-17(3)33/h15-16,19,21-22,27,36H,9-14H2,1-8H3,(H,39,40)/t15-,16+,19+,21-,22-,27+,30-,31-,32-/m0/s1

0 references

InChIKey

YCXUCEXEMJPDRZ-QWPKPZHNSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YCXUCEXEMJPDRZ-QWPKPZHNSA-N

SureChEMBL ID

SCHEMBL26959620

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

YCXUCEXEMJPDRZ-QWPKPZHNSA-N

1 reference

1 reference

matched by identifier from

InChIKey

YCXUCEXEMJPDRZ-QWPKPZHNSA-N

(Q104886532)

(2r,6s)-6-[(3s,5r,10s,12s,13r,14r,17r)-12-Acetoxy-3-hydroxy-4,4,10,13,14-pentamethyl-7,11,15-trioxo-1,2,3,5,6,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxo-heptanoic acid

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Identifiers

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