CINODINE I

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C37H59N13O13
Molecular Weight	893.9437
Optical Activity	UNSPECIFIED
Defined Stereocenters	13 / 13
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12NC(=O)N(C(N)=O)[C@@]1([H])[C@]([H])(O[C@@H]3CO[C@H](NC(=O)N[C@@H]4[C@@H](C)O[C@H](OC5=CC=C(\C=C\C(=O)NCCCNCCCCN)C=C5)[C@H](NC(N)=N)[C@H]4O)[C@H](NC(N)=O)[C@H]3O)OC[C@H]2O

InChI

InChIKey=DNVZVPOGAWMZMI-FWDCAGJFSA-N

InChI=1S/C37H59N13O13/c1-17-23(29(54)26(45-33(39)40)31(61-17)62-19-8-5-18(6-9-19)7-10-22(52)44-14-4-13-43-12-3-2-11-38)47-36(57)49-30-25(46-34(41)55)28(53)21(16-59-30)63-32-27-24(20(51)15-60-32)48-37(58)50(27)35(42)56/h5-10,17,20-21,23-32,43,51,53-54H,2-4,11-16,38H2,1H3,(H2,42,56)(H,44,52)(H,48,58)(H4,39,40,45)(H3,41,46,55)(H2,47,49,57)/b10-7+/t17-,20-,21-,23-,24+,25-,26-,27-,28+,29+,30+,31-,32+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C37H59N13O13
Molecular Weight	893.9437
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	13 / 13
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:28:32 GMT 2023` Edited by `admin` on `Fri Dec 15 15:28:32 GMT 2023`
Record UNII	G7J2ZAY23K
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CINODINE I

Common Name

English

ANTIBIOTIC BM-123.GAMMA.1

Common Name

English

CINODINE .GAMMA.(SUB 1)

Common Name

English

CINODINE-.GAMMA.1

Common Name

English

Code System Code Type Description

CAS

60830-76-4

Created by admin on Fri Dec 15 15:28:32 GMT 2023 , Edited by admin on Fri Dec 15 15:28:32 GMT 2023

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PUBCHEM

11981273

Created by admin on Fri Dec 15 15:28:32 GMT 2023 , Edited by admin on Fri Dec 15 15:28:32 GMT 2023

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FDA UNII

G7J2ZAY23K

Created by admin on Fri Dec 15 15:28:32 GMT 2023 , Edited by admin on Fri Dec 15 15:28:32 GMT 2023

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NCI_THESAURUS

C90679

Created by admin on Fri Dec 15 15:28:32 GMT 2023 , Edited by admin on Fri Dec 15 15:28:32 GMT 2023

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