(Q27134345)

English

5alpha,8alpha-epidioxycholest-6-en-3beta-ol

chemical compound

In more languages

Statements

type of chemical entity

0 references

cholestane steroid

0 references

0 references

416.329±0 dalton

1 reference

language of work or name

EnP(5,8) (English)

7 October 2016

stereoisomer of

(1R,2R,5R,6R,9R,10R,13S,15R)-6,10-dimethyl-5-[(2R)-6-methylheptan-2-yl]-16,17-dioxapentacyclo[13.2.2.01,9.02,6.010,15]nonadec-18-en-13-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₇H₄₄O₃

1 reference

language of work or name

EnP(5,8) (English)

7 October 2016

canonical SMILES

CC(C)CCCC(C)C1CCC2C1(CCC3C24C=CC5(C3(CCC(C5)O)C)OO4)C

1 reference

language of work or name

EnP(5,8) (English)

7 October 2016

isomeric SMILES

C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@]24C=C[C@@]5([C@@]3(CC[C@@H](C5)O)C)OO4)C

1 reference

language of work or name

EnP(5,8) (English)

7 October 2016

Diadema setosum

1 reference

Cytotoxic constituents of Diadema setosum

Aplysia dactylomela

1 reference

Marine natural products: halogenated acetylenic ethers from the sea hare Aplysia dactylomela

Aplysia juliana

1 reference

Studies on the constituents of marine opisthobranchia, III. Isolation and structure of two 5,8α-epidioxysterols and a cholesteryl ester mixture from the albumen gland ofAplysia juliana

Pyura microcosmus

1 reference

Isolation and bioactivities of epidioxysterol from the tunicate Cynthia savignyi

Glyptocidaris crenularis

1 reference

New N-acyl taurine from the sea urchin Glyptocidaris crenularis.

Metridium senile

1 reference

A novel sterol peroxide from the sea anenome Metridium senile

Trididemnum inarmatum

1 reference

5alpha,8alpha-Epidioxysterols from the gorgonian Eunicella cavolini and the ascidian Trididemnum inarmatum: isolation and evaluation of their antiproliferative activity

Identifiers

InChI=1S/C27H44O3/c1-18(2)7-6-8-19(3)21-9-10-22-24(21,4)13-12-23-25(5)14-11-20(28)17-26(25)15-16-27(22,23)30-29-26/h15-16,18-23,28H,6-14,17H2,1-5H3/t19-,20+,21-,22-,23-,24-,25-,26-,27+/m1/s1

1 reference

language of work or name

EnP(5,8) (English)

7 October 2016

FOISYVRNZSWLHL-MEKQHADNSA-N

2 references

language of work or name

EnP(5,8) (English)

7 October 2016

ChEBI release 2020-09-01

CAS Registry Number

2 references

language of work or name

5alpha,8alpha-epidioxycholest-6-en-3beta-ol (English)

7 October 2016

FOISYVRNZSWLHL-MEKQHADNSA-N

CAS Common Chemistry

10 April 2021

https://commonchemistry.cas.org/detail?cas_rn=14231-33-5

1 reference

language of work or name

(1S,2R,5R,6R,9R,10R,13S,15S)-6,10-Dimethyl-5-[(2R)-6-methyl-2-heptanyl]-16,17-dioxapentacyclo[13.2.2.0~1,9~.0~2,6~.0~10,15~]nonadec-18-en-13-ol (English)

7 October 2016

2 references

language of work or name

EnP(5,8) (English)

7 October 2016

matched by identifier from

FOISYVRNZSWLHL-MEKQHADNSA-N

Reaxys registry number

46010

1 reference

language of work or name

5alpha,8alpha-epidioxycholest-6-en-3beta-ol (English)

7 October 2016

mapping relation type

2 references

language of work or name

5alpha,8alpha-epidioxycholest-6-en-3beta-ol (English)

7 October 2016

matched by identifier from

International Chemical Identifier

InChI=1S/C27H44O3/c1-18(2)7-6-8-19(3)21-9-10-22-24(21,4)13-12-23-25(5)14-11-20(28)17-26(25)15-16-27(22,23)30-29-26/h15-16,18-23,28H,6-14,17H2,1-5H3/t19-,20+,21-,22-,23-,24-,25-,26-,27+/m1/s1

1 reference

language of work or name

CHEMBL453272 (English)

7 October 2016

UniChem compound ID

1 reference

DSSTox substance ID

DTXSID101275867

1 reference

matched by identifier from

FOISYVRNZSWLHL-MEKQHADNSA-N

1 reference

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

30 June 2018

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