ORITAVANCIN DIPHOSPHATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C86H97Cl3N10O26.2H3O4P
Molecular Weight	1989.091
Optical Activity	UNSPECIFIED
Defined Stereocenters	22 / 22
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OP(O)(O)=O.OP(O)(O)=O.[H][C@@]1(C[C@](C)(NCC2=CC=C(C=C2)C3=CC=C(Cl)C=C3)[C@@H](O)[C@H](C)O1)O[C@@H]4[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]4OC5=C6OC7=CC=C(C=C7Cl)[C@@H](O)[C@@H](NC(=O)[C@@H](CC(C)C)NC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@]8([H])C(C=C5OC9=C(Cl)C=C(C=C9)[C@@H](O[C@@]%10([H])C[C@](C)(N)[C@@H](O)[C@H](C)O%10)[C@]%11([H])NC(=O)[C@]([H])(NC8=O)C%12=CC=C(O)C(=C%12)C%13=C(C=C(O)C=C%13O)[C@]([H])(NC%11=O)C(O)=O)=C6

InChI

InChIKey=PWTROOMOPLCZHB-BHYQHFGMSA-N

InChI=1S/C86H97Cl3N10O26.2H3O4P/c1-35(2)22-51(92-7)77(110)98-67-69(105)42-15-20-55(49(88)24-42)120-57-26-44-27-58(73(57)125-84-74(71(107)70(106)59(34-100)122-84)124-62-32-86(6,76(109)37(4)119-62)93-33-38-8-10-39(11-9-38)40-12-17-45(87)18-13-40)121-56-21-16-43(25-50(56)89)72(123-61-31-85(5,91)75(108)36(3)118-61)68-82(115)97-66(83(116)117)48-28-46(101)29-54(103)63(48)47-23-41(14-19-53(47)102)64(79(112)99-68)96-80(113)65(44)95-78(111)52(30-60(90)104)94-81(67)114;2*1-5(2,3)4/h8-21,23-29,35-37,51-52,59,61-62,64-72,74-76,84,92-93,100-103,105-109H,22,30-34,91H2,1-7H3,(H2,90,104)(H,94,114)(H,95,111)(H,96,113)(H,97,115)(H,98,110)(H,99,112)(H,116,117);2*(H3,1,2,3,4)/t36-,37-,51+,52-,59+,61-,62-,64+,65+,66-,67+,68-,69+,70+,71-,72+,74+,75-,76-,84-,85-,86-;;/m0../s1

HIDE SMILES / InChI

Molecular Formula	C86H97Cl3N10O26
Molecular Weight	1793.101
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	22 / 22
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	H3O4P
Molecular Weight	97.9952
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:20:23 UTC 2023` Edited by `admin` on `Fri Dec 15 18:20:23 UTC 2023`
Record UNII	VL1P93MKZN
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ORITAVANCIN DIPHOSPHATE

Official Name

English

KIMYRSA

Brand Name

English

NUVOCID

Brand Name

English

ORITAVANCIN DIPHOSPHATE [USAN]

Common Name

English

LY333328 DIPHOSPHATE

Code

English

ORITAVANCIN DIPHOSPHATE [MI]

Common Name

English

VANCOMYCIN, 22-O-(3-AMINO-2,3,6-TRIDEOXY-3-C-METHYL-.ALPHA.-L-ARABINO-HEXOPYRANOSYL)-N3''-((4'-CHLORO(1,1'-BIPHENYL)-4-YL)METHYL)-, (4''R)-, PHOSPHATE (1:2)

Systematic Name

English

VANCOMYCIN, 22-O-(3-AMINO-2,3,6-TRIDEOXY-3-C-METHYL-.ALPHA.-L-ARABINO-HEXOPYRANOSYL)-N3''-((4'-CHLORO(1,1'-BIPHENYL)-4-YL)METHYL)-, (4''R)-, PHOSPHATE (1:2) (SALT)

Systematic Name

English

ORITAVANCIN DIPHOSPHATE [ORANGE BOOK]

Common Name

English

LY-333328 DIPHOSPHATE

Code

English

Oritavancin diphosphate [WHO-DD]

Common Name

English

ORITAVANCIN PHOSPHATE [MART.]

Common Name

English

ORITAVANCIN DIPHOSPHATE [VANDF]

Common Name

English

ORBACTIV

Brand Name

English

Classification Tree Code System Code

EMA ASSESSMENT REPORTS

ORBACTIV (AUTHORIZED SOFT TISSUE INFECTIONS)