ZIFANOCYCLINE

Details

Stereochemistry	MIXED
Molecular Formula	C29H36N4O7
Molecular Weight	552.6187
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC3=C(C=C(CN4CC5CC5C4)C(O)=C3C(=O)C1=C(O)[C@]6(O)C(=O)C(C(N)=O)=C(O)[C@@H](N(C)C)[C@]6([H])C2)N(C)C

InChI

InChIKey=YOOGAONNHXDMEQ-OMBSCLNISA-N

InChI=1S/C29H36N4O7/c1-31(2)18-8-15(11-33-9-13-5-14(13)10-33)23(34)20-16(18)6-12-7-17-22(32(3)4)25(36)21(28(30)39)27(38)29(17,40)26(37)19(12)24(20)35/h8,12-14,17,22,34,36-37,40H,5-7,9-11H2,1-4H3,(H2,30,39)/t12-,13?,14?,17-,22-,29-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C29H36N4O7
Molecular Weight	552.6187
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	4 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:02:40 UTC 2023` Edited by `admin` on `Sat Dec 16 19:02:40 UTC 2023`
Record UNII	5G7H4PZ1SU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ZIFANOCYCLINE

Official Name

English

(4S,4AS,5AR,12AS)-9-(3-AZABICYCLO(3.1.0)HEXAN-3- YLMETHYL)-4,7-BIS(DIMETHYLAMINO)-3,10,12,12ATETRAHYDROXY- 1,11-DIOXO-1, 4,4A,5,5A,6,11,12AOCTAHYDROTETRACENE- 2-CARBOXAMIDE

Systematic Name

English

zifanocycline [INN]

Common Name

English

2-NAPHTHACENECARBOXAMIDE, 9-(3-AZABICYCLO(3.1.0)HEX-3-YLMETHYL)-4,7-BIS(DIMETHYLAMINO)-1,4,4A,5,5A,6,11,12A-OCTAHYDRO-3,10,12,12A-TETRAHYDROXY-1,11-DIOXO-, (4S,4AS,5AR,12AS)-

Systematic Name

English

Code System Code Type Description

SMS_ID

300000039031