(Q104998454)

English

[(3S,5S,9R,10S,13R,14R,17R)-17-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hexadecanoate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

Ergosta-7,22-dien-3beta-yl palmitate

1 reference

based on heuristic

inferred from SMILES

[17-(5,6-dimethylhept-3-en-2-yl)-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hexadecanoate

1 reference

based on heuristic

inferred from SMILES

mass

636.584531672 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(3S,5R,9R,10S,13R,14R,17R)-17-[(E,2S,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hexadecanoate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₄₄H₇₆O₂

0 references

canonical SMILES

O=C(OC1CCC2(C)C3C(=CCC2C1)C4CCC(C(C=CC(C)C(C)C)C)C4(C)CC3)CCCCCCCCCCCCCCC

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isomeric SMILES

CCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC=C3[C@@H]2CC[C@@]2(C)[C@H]3CC[C@@H]2[C@H](C)/C=C/[C@H](C)C(C)C)C1

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found in taxon

Agaricus amboinensis

1 reference

stated in

Steroids of formosan Ganoderma amboinense

Ganoderma amboinense

1 reference

stated in

Steroids of formosan Ganoderma amboinense

Ganoderma applanatum

1 reference

stated in

Steroidal constituents of ganoderma applanatum and ganodermaneo-japonicum

Ganoderma lucidum

3 references

stated in

Antiinflammatory triterpenoids and steroids from Ganoderma lucidum and G. tsugae

stated in

A lanostanoid of formosan Ganoderma lucidum

stated in

Secondary metabolites from Ganoderma lucidum and Spongiporus leucomallellus

Ganoderma tsugae

1 reference

stated in

Antiinflammatory triterpenoids and steroids from Ganoderma lucidum and G. tsugae

Identifiers

InChI

InChI=1S/C44H76O2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-42(45)46-37-28-30-43(6)36(32-37)24-25-38-40-27-26-39(44(40,7)31-29-41(38)43)35(5)23-22-34(4)33(2)3/h22-23,25,33-37,39-41H,8-21,24,26-32H2,1-7H3/b23-22+/t34-,35+,36-,37-,39+,40-,41-,43-,44+/m0/s1

0 references

InChIKey

FNQWAQSWCDRWDH-XSMSLXMBSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

FNQWAQSWCDRWDH-XSMSLXMBSA-N

LIPID MAPS ID

LMST01031145

1 reference

InChIKey

FNQWAQSWCDRWDH-XSMSLXMBSA-N

17 April 2021

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download

(Q104998454)

[(3S,5S,9R,10S,13R,14R,17R)-17-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hexadecanoate

Statements

Identifiers

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