penmesterol (Q15633969)

PENMESTEROL (English)

14 October 2016

chemical formula

C₂₅H₃₈O₂

1 reference

PENMESTEROL (English)

14 October 2016

canonical SMILES

CC12CCC(=CC1=CCC3C2CCC4(C3CCC4(C)O)C)OC5CCCC5

1 reference

PENMESTEROL (English)

14 October 2016

isomeric SMILES

C[C@]12CCC(=CC1=CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@]4(C)O)C)OC5CCCC5

1 reference

PENMESTEROL (English)

InChI=1S/C25H38O2/c1-23-13-10-19(27-18-6-4-5-7-18)16-17(23)8-9-20-21(23)11-14-24(2)22(20)12-15-25(24,3)26/h8,16,18,20-22,26H,4-7,9-15H2,1-3H3/t20-,21+,22+,23+,24+,25+/m1/s1

14 October 2016

Identifiers

InChI

1 reference

PENMESTEROL (English)

ZUBDXGHKAAMAAA-RFXJPFPRSA-N

14 October 2016

InChIKey

2 references

PENMESTEROL (English)

14 October 2016

ChEBI release 2020-09-01

CAS Registry Number

67-81-2

2 references

Global Substance Registration System

penmesterol (English)

ZUBDXGHKAAMAAA-RFXJPFPRSA-N

14 October 2016

InChIKey

9 April 2021

https://commonchemistry.cas.org/detail?cas_rn=67-81-2

1 reference

Penmesterol (English)

14 October 2016

1 reference

PENMESTEROL (English)

14 October 2016

ChEBI ID

135567

mapping relation type

exact match

1 reference

ChEBI release 2019-10-02

1 reference

PENMESTEROL (English)

14 October 2016

1 reference

200-670-6

1 reference

Global Substance Registration System

penmesterol (English)

ECHA Substance Infocard ID

14 October 2016

100.000.609

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.000.609

27 December 2018

Penmesterol (English)

quotation

CAS no.: 67-81-2 (English)

1 reference

Global Substance Registration System