4-O-DEACETYLVINORELBINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C43H52N4O7
Molecular Weight	736.8956
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12N3CC[C@@]14C5=CC(=C(OC)C=C5N(C)[C@@]4([H])[C@](O)([C@H](O)[C@]2(CC)C=CC3)C(=O)OC)[C@]6(C[C@H]7CN(CC(CC)=C7)CC8=C6NC9=C8C=CC=C9)C(=O)OC

InChI

InChIKey=OBAOAFYUDIHEFP-KMYMPCDISA-N

InChI=1S/C43H52N4O7/c1-7-25-18-26-21-42(38(49)53-5,34-28(24-46(22-25)23-26)27-12-9-10-13-31(27)44-34)30-19-29-32(20-33(30)52-4)45(3)36-41(29)15-17-47-16-11-14-40(8-2,35(41)47)37(48)43(36,51)39(50)54-6/h9-14,18-20,26,35-37,44,48,51H,7-8,15-17,21-24H2,1-6H3/t26-,35-,36+,37+,40+,41+,42-,43-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C43H52N4O7
Molecular Weight	736.8956
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 8
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 15:15:13 UTC 2023` Edited by `admin` on `Sat Dec 16 15:15:13 UTC 2023`
Record UNII	XKD4U87SZY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-O-DEACETYLVINORELBINE

Common Name

English

DEACETYL VINORELBINE

Common Name

English

VINORELBINE TARTRATE IMPURITY B [EP IMPURITY]

Common Name

English

ASPIDOSPERMIDINE-3-CARBOXYLIC ACID, 6,7-DIDEHYDRO-15-((2R,6R,8S)-4-ETHYL-1,3,6,7,8,9-HEXAHYDRO-8-(METHOXYCARBONYL)-2,6-METHANO-2H-AZECINO(4,3-B)INDOL-8-YL)-3,4-DIHYDROXY-16-METHOXY-1-METHYL-, METHYL ESTER, (2.BETA.,3.BETA.,4.BETA.,5.ALPHA.,12R,19.ALPHA.)-

Systematic Name

English

VINORELBINE RELATED COMPOUND A [USP IMPURITY]

Common Name

English

O4-DEACETYL-4-DEOXY-3,4-DIDEHYDRO-8-NORVINCALEUKOBLASTINE

Systematic Name

English

O-DEACETYLNAVELBINE

Common Name

English

Code System Code Type Description

PUBCHEM

21783126

Created by admin on Sat Dec 16 15:15:14 UTC 2023 , Edited by admin on Sat Dec 16 15:15:14 UTC 2023

PRIMARY

CAS

126347-74-8

Created by admin on Sat Dec 16 15:15:14 UTC 2023 , Edited by admin on Sat Dec 16 15:15:14 UTC 2023

PRIMARY

EPA CompTox

DTXSID10925513

Created by admin on Sat Dec 16 15:15:14 UTC 2023 , Edited by admin on Sat Dec 16 15:15:14 UTC 2023

PRIMARY

FDA UNII

XKD4U87SZY

Created by admin on Sat Dec 16 15:15:14 UTC 2023 , Edited by admin on Sat Dec 16 15:15:14 UTC 2023

PRIMARY

Related Record Type Details


					253GQW851Q

VINORELBINE TARTRATE

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Interaction Type:

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Qualification:

USP

Amount:


					253GQW851Q

VINORELBINE TARTRATE

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

EP

Amount: