TP-2758

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C28H35N3O8
Molecular Weight	541.5928
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]1(CCCN1CC)C2=CC(O)=C3C(=O)C4=C(O)[C@]5(O)C(=O)C(C(N)=O)=C(O)[C@@H](N(C)C)[C@]5([H])C[C@]4([H])CC3=C2OC

InChI

InChIKey=ITOPIPGRIRGPED-MEKZYAFBSA-N

InChI=1S/C28H35N3O8/c1-5-31-8-6-7-16(31)13-11-17(32)19-14(24(13)39-4)9-12-10-15-21(30(2)3)23(34)20(27(29)37)26(36)28(15,38)25(35)18(12)22(19)33/h11-12,15-16,21,32,34-35,38H,5-10H2,1-4H3,(H2,29,37)/t12-,15-,16-,21-,28-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C28H35N3O8
Molecular Weight	541.5928
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:14:50 GMT 2023` Edited by `admin` on `Sat Dec 16 19:14:50 GMT 2023`
Record UNII	97PE7FME5A
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TP-2758

Common Name

English

(4S,4aS,5aR,12aS)-4-(Dimethylamino)-8-[(2S)-1-ethyl-2-pyrrolidinyl]-1,4,4a,5,5a,6,11,12a-octahydro-3,10,12,12a-tetrahydroxy-7-methoxy-1,11-dioxo-2-naphthacenecarboxamide

Systematic Name

English

2-Naphthacenecarboxamide, 4-(dimethylamino)-8-[(2S)-1-ethyl-2-pyrrolidinyl]-1,4,4a,5,5a,6,11,12a-octahydro-3,10,12,12a-tetrahydroxy-7-methoxy-1,11-dioxo-, (4S,4aS,5aR,12aS)-

Systematic Name

English

Code System Code Type Description

CAS

1359296-97-1

Created by admin on Sat Dec 16 19:14:50 GMT 2023 , Edited by admin on Sat Dec 16 19:14:50 GMT 2023

PRIMARY

FDA UNII

97PE7FME5A

Created by admin on Sat Dec 16 19:14:50 GMT 2023 , Edited by admin on Sat Dec 16 19:14:50 GMT 2023

PRIMARY

Related Record Type Details


					BTT4QAV5ST

TP-2758 hydrochloride

SALT/SOLVATE -> PARENT

Amount: