(Q27274093)

ESTRIOL SUCCINATE (English)

14 October 2016

chemical formula

C₂₆H₃₂O₉

1 reference

ESTRIOL SUCCINATE (English)

19 November 2016

canonical SMILES

CC12CCC3C(C1CC(C2OC(=O)CCC(=O)O)OC(=O)CCC(=O)O)CCC4=C3C=CC(=C4)O

1 reference

ESTRIOL SUCCINATE (English)

19 November 2016

isomeric SMILES

C[C@]12CC[C@H]3[C@H]([C@@H]1C[C@H]([C@@H]2OC(=O)CCC(=O)O)OC(=O)CCC(=O)O)CCC4=C3C=CC(=C4)O

1 reference

ESTRIOL SUCCINATE (English)

InChI=1S/C26H32O9/c1-26-11-10-17-16-5-3-15(27)12-14(16)2-4-18(17)19(26)13-20(34-23(32)8-6-21(28)29)25(26)35-24(33)9-7-22(30)31/h3,5,12,17-20,25,27H,2,4,6-11,13H2,1H3,(H,28,29)(H,30,31)/t17-,18-,19+,20-,25+,26+/m1/s1

19 November 2016

MCN code

3003.39.33

0 references

Identifiers

InChI

1 reference

ESTRIOL SUCCINATE (English)

VBRVDDFOBZNCPF-BRSFZVHSSA-N

19 November 2016

InChIKey

2 references

ESTRIOL SUCCINATE (English)

19 November 2016

ChEBI release 2020-09-01

CAS Registry Number

514-68-1

2 references

estriol succinate (English)

VBRVDDFOBZNCPF-BRSFZVHSSA-N

19 November 2016

InChIKey

8 April 2021

https://commonchemistry.cas.org/detail?cas_rn=514-68-1

1 reference

estriol succinate (English)

19 November 2016

1 reference

ESTRIOL SUCCINATE (English)

19 November 2016

ChEBI ID

135790

mapping relation type

exact match

1 reference

ChEBI release 2019-10-02

1 reference

208-185-1

1 reference

estriol succinate (English)

ECHA Substance Infocard ID

19 November 2016

100.007.442

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.007.442

27 December 2018

Estriol succinate (English)

quotation

CAS no.: 514-68-1 (English)

RxNorm ID

24416

1 reference

estriol succinate (English)

19 November 2016

1 reference