TAXININE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C35H42O9
Molecular Weight	606.7026
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12CC(=O)C(C)=C([C@@H](OC(C)=O)[C@H](OC(C)=O)[C@]3(C)CC[C@H](OC(=O)\C=C\C4=CC=CC=C4)C(=C)[C@@]3([H])[C@@H]1OC(C)=O)C2(C)C

InChI

InChIKey=BAYHEZUZRPMUDM-RZHPVIQDSA-N

InChI=1S/C35H42O9/c1-19-26(39)18-25-31(41-21(3)36)30-20(2)27(44-28(40)15-14-24-12-10-9-11-13-24)16-17-35(30,8)33(43-23(5)38)32(42-22(4)37)29(19)34(25,6)7/h9-15,25,27,30-33H,2,16-18H2,1,3-8H3/b15-14+/t25-,27-,30-,31+,32+,33-,35+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C35H42O9
Molecular Weight	606.7026
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:03:27 GMT 2023` Edited by `admin` on `Sat Dec 16 10:03:27 GMT 2023`
Record UNII	B7554596HX
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TAXININE

Common Name

English

TAXININ

Common Name

English

2-PROPENOIC ACID, 3-PHENYL-, (3S,4AR,5R,6R,11R,12R,12AR)-5,11,12-TRIS(ACETYLOXY)-1,2,3,4,4A,5,6,7,8,11,12,12A-DODECAHYDRO-9,12A,13,13-TETRAMETHYL-4-METHYLENE-8-OXO-6,10-METHANOBENZOCYCLODECEN-3-YL ESTER, (2E)-

Systematic Name

English

CINNAMIC ACID, 3-ESTER WITH 1,3,4,4A.ALPHA.,5,6.BETA.,7,11,12,12A-DECAHYDRO-3.ALPHA.,5.ALPHA.,11.BETA.,12.ALPHA.-TETRAHYDROXY-9,12A.BETA.,13,13-TETRAMETHYL-4-METHYLENE-6,10-METHANOBENZOCYCLODECEN-8(2H)-ONE TRIACETATE

Common Name

English

O-CINNAMOYLTAXICIN-II TRIACETATE [MI]

Common Name

English

TAXININE, (+)-

Common Name

English

Code System Code Type Description

FDA UNII

B7554596HX

Created by admin on Sat Dec 16 10:03:27 GMT 2023 , Edited by admin on Sat Dec 16 10:03:27 GMT 2023

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PUBCHEM

10054413

Created by admin on Sat Dec 16 10:03:27 GMT 2023 , Edited by admin on Sat Dec 16 10:03:27 GMT 2023

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MERCK INDEX

m10484

Created by admin on Sat Dec 16 10:03:27 GMT 2023 , Edited by admin on Sat Dec 16 10:03:27 GMT 2023

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Merck Index

CAS

3835-52-7

Created by admin on Sat Dec 16 10:03:27 GMT 2023 , Edited by admin on Sat Dec 16 10:03:27 GMT 2023

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