(Q27256314)

SCHEMBL136944 (English)

18 November 2016

chemical formula

C₃₁H₃₇NO₇

1 reference

SCHEMBL136944 (English)

18 November 2016

canonical SMILES

CC=CC1OC23CCC(C2(CC(C4C3CCC5=CC(=O)CCC45C)O)C)(O1)C(=O)COC(=O)C6=CC=NC=C6

1 reference

SCHEMBL136944 (English)

18 November 2016

isomeric SMILES

C/C=C\C1O[C@@]23CC[C@]([C@]2(C[C@@H]([C@H]4[C@H]3CCC5=CC(=O)CC[C@]45C)O)C)(O1)C(=O)COC(=O)C6=CC=NC=C6

1 reference

SCHEMBL136944 (English)

InChI=1S/C31H37NO7/c1-4-5-25-38-30-12-13-31(39-25,24(35)18-37-27(36)19-9-14-32-15-10-19)29(30,3)17-23(34)26-22(30)7-6-20-16-21(33)8-11-28(20,26)2/h4-5,9-10,14-16,22-23,25-26,34H,6-8,11-13,17-18H2,1-3H3/b5-4-/t22-,23+,25?,26-,28+,29+,30-,31+/m1/s1

18 November 2016

Identifiers

InChI

1 reference

SCHEMBL136944 (English)

LZHLAFIPUJPCBN-ZTOAAZPKSA-N

18 November 2016

InChIKey

1 reference

Global Substance Registration System

SCHEMBL136944 (English)

18 November 2016

1 reference

nicocortonide (English)

18 November 2016

1 reference

nicocortonide (English)

18 November 2016

1 reference

Global Substance Registration System

SCHEMBL136944 (English)

18 November 2016

1 reference

265-754-7

1 reference

stated in

nicocortonide (English)

ECHA Substance Infocard ID

18 November 2016

100.059.759

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.059.759

27 December 2018

Nicocortonide (English)

quotation

CAS no.: 65415-41-0 (English)

Global Substance Registration System

1 reference

stated in

nicocortonide (English)