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Details

Stereochemistry ABSOLUTE
Molecular Formula C33H47N5O8.4ClH
Molecular Weight 787.599
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of F-14512 HYDROCHLORIDE

SMILES

Cl.Cl.Cl.Cl.[H][C@]12COC(=O)[C@]1([H])[C@H](C3=CC(OC)=C(O)C(OC)=C3)C4=C(C=C5OCOC5=C4)[C@H]2NC(=O)CNCCCNCCCCNCCCN

InChI

InChIKey=QGRQOKJRPFFPKH-HADUGAHKSA-N
InChI=1S/C33H47N5O8.4ClH/c1-42-26-13-20(14-27(43-2)32(26)40)29-21-15-24-25(46-19-45-24)16-22(21)31(23-18-44-33(41)30(23)29)38-28(39)17-37-12-6-11-36-9-4-3-8-35-10-5-7-34;;;;/h13-16,23,29-31,35-37,40H,3-12,17-19,34H2,1-2H3,(H,38,39);4*1H/t23-,29+,30-,31+;;;;/m0..../s1

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C33H47N5O8
Molecular Weight 641.755
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 13:49:21 GMT 2023
Edited
by admin
on Sat Dec 16 13:49:21 GMT 2023
Record UNII
7TA4W0PN0M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
F-14512 HYDROCHLORIDE
Code English
ACETAMIDE, 2-((3-((4-((3-AMINOPROPYL)AMINO)BUTYL)AMINO)PROPYL)AMINO)-N-((5S,5AS,8AR,9R)-5,5A,6,8,8A,9-HEXAHYDRO-9-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-8-OXOFURO(3',4':6,7)NAPHTHO(2,3-D)-1,3-DIOXOL-5-YL)-, TETRAHYDROCHLORIDE
Systematic Name English
ACETAMIDE, 2-((3-((4-((3-AMINOPROPYL)AMINO)BUTYL)AMINO)PROPYL)AMINO)-N-((5S,5AS,8AR,9R)-5,5A,6,8,8A,9-HEXAHYDRO-9-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-8-OXOFURO(3',4':6,7)NAPHTHO(2,3-D)-1,3-DIOXOL-5-YL)-, HYDROCHLORIDE (1:4)
Systematic Name English
2-((3-((4-((3-AMINOPROPYL)AMINO)BUTYL)AMINO)PROPYL)AMINO)-N-((5S,5AS,8AR,9R)-9-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-8-OXO-5,5A,6,8,8A,9-HEXAHYDROFURO(3',4':6,7)NAPHTHO(2,3-D)(1,3)DIOXOL-5-YL)ACETAMIDE, TETRAHYDROCHLORIDE
Systematic Name English
Code System Code Type Description
PUBCHEM
139593418
Created by admin on Sat Dec 16 13:49:21 GMT 2023 , Edited by admin on Sat Dec 16 13:49:21 GMT 2023
PRIMARY
CAS
866874-39-7
Created by admin on Sat Dec 16 13:49:21 GMT 2023 , Edited by admin on Sat Dec 16 13:49:21 GMT 2023
PRIMARY Scifinder
EU-Orphan Drug
EU/3/15/1517
Created by admin on Sat Dec 16 13:49:21 GMT 2023 , Edited by admin on Sat Dec 16 13:49:21 GMT 2023
PRIMARY TREATMENT OF ACUTE MYELOID LEUKAEMIA 28/07/2015 POSITIVE
SMS_ID
300000010761
Created by admin on Sat Dec 16 13:49:21 GMT 2023 , Edited by admin on Sat Dec 16 13:49:21 GMT 2023
PRIMARY
FDA UNII
7TA4W0PN0M
Created by admin on Sat Dec 16 13:49:21 GMT 2023 , Edited by admin on Sat Dec 16 13:49:21 GMT 2023
PRIMARY
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