Paclitaxel succinate

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C51H55NO17
Molecular Weight	953.9789
Optical Activity	( - )
Defined Stereocenters	11 / 11
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(=O)O[C@@H]1C2=C(C)[C@H](C[C@@](O)([C@@H](OC(=O)C3=CC=CC=C3)[C@@H]4[C@@]5(CO[C@@H]5C[C@H](O)[C@@]4(C)C1=O)OC(C)=O)C2(C)C)OC(=O)[C@H](OC(=O)CCC(O)=O)[C@@H](NC(=O)C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChIKey=RBNOJYDPFALIQZ-LAVNIZMLSA-N

InChI=1S/C51H55NO17/c1-27-33(66-47(62)41(67-37(58)23-22-36(56)57)39(30-16-10-7-11-17-30)52-45(60)31-18-12-8-13-19-31)25-51(63)44(68-46(61)32-20-14-9-15-21-32)42-49(6,34(55)24-35-50(42,26-64-35)69-29(3)54)43(59)40(65-28(2)53)38(27)48(51,4)5/h7-21,33-35,39-42,44,55,63H,22-26H2,1-6H3,(H,52,60)(H,56,57)/t33-,34-,35+,39-,40+,41+,42-,44-,49+,50-,51+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C51H55NO17
Molecular Weight	953.9789
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	11 / 11
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 17:18:31 GMT 2025` Edited by `admin` on `Wed Apr 02 17:18:31 GMT 2025`
Record UNII	HQF3Z46VKD
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Butanedioic acid, 1-[(1R,2S)-2-(benzoylamino)-1-[[[(2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-6,12b-bis(acetyloxy)-12-(benzoyloxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-4,11-dihydroxy-4a,8,13,13-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b

Preferred Name

English

Paclitaxel succinate

Common Name

English

Butanedioic acid, mono[(1R,2S)-2-(benzoylamino)-1-[[[(2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-6,12b-bis(acetyloxy)-12-(benzoyloxy)-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-4,11-dihydroxy-4a,8,13,13-tetramethyl-5-oxo-7,11-methano-1H-cyclodeca[3,4]benz[1,2

Systematic Name

English

Code System Code Type Description

FDA UNII

HQF3Z46VKD

Created by admin on Wed Apr 02 17:18:31 GMT 2025 , Edited by admin on Wed Apr 02 17:18:31 GMT 2025

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PUBCHEM

25024567

Created by admin on Wed Apr 02 17:18:31 GMT 2025 , Edited by admin on Wed Apr 02 17:18:31 GMT 2025

PRIMARY

CAS

117527-50-1

Created by admin on Wed Apr 02 17:18:31 GMT 2025 , Edited by admin on Wed Apr 02 17:18:31 GMT 2025

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EPA CompTox

DTXSID801315159

Created by admin on Wed Apr 02 17:18:31 GMT 2025 , Edited by admin on Wed Apr 02 17:18:31 GMT 2025

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