6.ALPHA.-HYDROXYPACLITAXEL

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C47H51NO15
Molecular Weight	869.9055
Optical Activity	UNSPECIFIED
Defined Stereocenters	12 / 12
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]5[C@@H](O)[C@H](O)[C@@]4(C)C1=O)OC(C)=O)C2(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChIKey=NDCWHEDPSFRTDA-FJMWQILYSA-N

InChI=1S/C47H51NO15/c1-24-30(61-43(57)33(51)32(27-16-10-7-11-17-27)48-41(55)28-18-12-8-13-19-28)22-47(58)40(62-42(56)29-20-14-9-15-21-29)36-45(6,38(54)35(60-25(2)49)31(24)44(47,4)5)37(53)34(52)39-46(36,23-59-39)63-26(3)50/h7-21,30,32-37,39-40,51-53,58H,22-23H2,1-6H3,(H,48,55)/t30-,32-,33+,34-,35+,36-,37-,39+,40-,45-,46+,47+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C47H51NO15
Molecular Weight	869.9055
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	12 / 12
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:11:52 GMT 2025` Edited by `admin` on `Mon Mar 31 21:11:52 GMT 2025`
Record UNII	P97L07N47V
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

6.ALPHA.-HYDROXYPACLITAXEL

Common Name

English

6.ALPHA.-HYDROXYTAXOL

Preferred Name

English

Code System Code Type Description

SMS_ID

300000052878

Created by admin on Mon Mar 31 21:11:52 GMT 2025 , Edited by admin on Mon Mar 31 21:11:52 GMT 2025

PRIMARY

CAS

153212-75-0

Created by admin on Mon Mar 31 21:11:52 GMT 2025 , Edited by admin on Mon Mar 31 21:11:52 GMT 2025

PRIMARY

FDA UNII

P97L07N47V

Created by admin on Mon Mar 31 21:11:52 GMT 2025 , Edited by admin on Mon Mar 31 21:11:52 GMT 2025

PRIMARY

PUBCHEM

10056458

Created by admin on Mon Mar 31 21:11:52 GMT 2025 , Edited by admin on Mon Mar 31 21:11:52 GMT 2025

PRIMARY

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