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Details

Stereochemistry ABSOLUTE
Molecular Formula C28H38O10
Molecular Weight 534.5953
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TAXINE B

SMILES

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

InChI

InChIKey=MLYDZECFCXRQOK-IANSKHESSA-N
InChI=1S/C28H38O10/c1-13-21(35-14(2)29)10-19-22(36-15(3)30)9-18-12-28(8,23(11-20(18)33)37-16(4)31)26(34)25(38-17(5)32)24(13)27(19,6)7/h9,19-23,25,33H,10-12H2,1-8H3/b18-9+/t19-,20-,21-,22-,23-,25+,28-/m0/s1

HIDE SMILES / InChI

Molecular Formula C28H38O10
Molecular Weight 534.5953
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:34:19 GMT 2023
Edited
by admin
on Sat Dec 16 09:34:19 GMT 2023
Record UNII
CEB5005PDD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TAXINE B
Common Name English
TAXIN B
Common Name English
TAXIN B, (-)-
Common Name English
TRICYCLO(9.3.1.14,8)HEXADECA-4,10-DIEN-2-ONE, 3,6,9,14-TETRAKIS(ACETYLOXY)-12-HYDROXY-1,5,16,16-TETRAMETHYL-, (1S,3R,6S,8R,9S,10E,12S,14S)-
Systematic Name English
Code System Code Type Description
CAS
168109-52-2
Created by admin on Sat Dec 16 09:34:19 GMT 2023 , Edited by admin on Sat Dec 16 09:34:19 GMT 2023
PRIMARY
FDA UNII
CEB5005PDD
Created by admin on Sat Dec 16 09:34:19 GMT 2023 , Edited by admin on Sat Dec 16 09:34:19 GMT 2023
PRIMARY
PUBCHEM
5321699
Created by admin on Sat Dec 16 09:34:19 GMT 2023 , Edited by admin on Sat Dec 16 09:34:19 GMT 2023
PRIMARY
CHEBI
134192
Created by admin on Sat Dec 16 09:34:19 GMT 2023 , Edited by admin on Sat Dec 16 09:34:19 GMT 2023
PRIMARY