SAFRAMYCIN A

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H30N4O8
Molecular Weight	562.5705
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC3=C([C@H](CNC(=O)C(C)=O)N1[C@@H](C#N)[C@@H]4CC5=C([C@H]2N4C)C(=O)C(OC)=C(C)C5=O)C(=O)C(OC)=C(C)C3=O

InChI

InChIKey=JNEGMBHBUAJRSX-KRPZRDOVSA-N

InChI=1S/C29H30N4O8/c1-11-23(35)14-8-17-22-21-15(24(36)12(2)28(41-6)26(21)38)7-16(32(22)4)18(9-30)33(17)19(10-31-29(39)13(3)34)20(14)25(37)27(11)40-5/h16-19,22H,7-8,10H2,1-6H3,(H,31,39)/t16?,17-,18-,19-,22?/m0/s1

HIDE SMILES / InChI

Molecular Formula	C29H30N4O8
Molecular Weight	562.5705
Charge	0
Count

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

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:06:59 GMT 2023` Edited by `admin` on `Fri Dec 15 18:06:59 GMT 2023`
Record UNII	MJW34HDB0D
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SAFRAMYCIN A

Common Name

English

NSC-325663

Code

English

SFM-A

Common Name

English

PROPANAMIDE, N-(((6S,7R,9R,14AS,15R)-7-CYANO-1,5,6,7,9,10,13,14,14A,15-DECAHYDRO-2,11-DIMETHOXY-3,12,16-TRIMETHYL-1,4,10,13-TETRAOXO-6,15-IMINO-4H-ISOQUINO(3,2-B)(3)BENZAZOCIN-9-YL)METHYL)-2-OXO-

Systematic Name

English

SAFRAMYCIN A, (-)

Common Name

English

Code System Code Type Description

CAS

66082-27-7