Chem
J-GLOBAL ID:200907097496677467
Nikkaji number:J1.570.052A
9,10-trans-Didehydroepothilone D
9,10-trans-ジデヒドロエポチロンD
Download MOL file
Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C27 H39 NO5 S
Molecular formula furigana:
C27-H39-N-O5-S
Molecular weight:
489.670
InChI:
InChI=1S/C27H39NO5S/c1-16-9-8-10-17(2)25(31)19(4)26(32)27(6,7)23(29)14-24(30)33-22(12-11-16)18(3)13-21-15-34-20(5)28-21/h8,10-11,13,15,17,19,22-23,25,29,31H,9,12,14H2,1-7H3/b10-8+,16-11-,18-13+/t17-,19+,22-,23-,25?/m0/s1
InChI key:
XAYAKDZVINDZGB-XAZSEJOZSA-N
SMILES:
C[C@H]1/C=C/C/C(=C\C[C@H](OC(=O)C[C@H](O)C(C)(C)C(=O)[C@H](C)C1O)/C(=C/c1csc(C)n1)/C)/C
Systematic name (5):
(4S,10E,13Z)-4α,8β-ジヒドロキシ-5,5,7α,9β,13-ペンタメチル-16β-[(E)-1-メチル-2-(2-メチル-4-チアゾリル)エテニル]-1-オキサシクロヘキサデカン-10,13-ジエン-2,6-ジオン
(4S,7R,8S,9S,10E,13Z,16S)-4,8-ジヒドロキシ-5,5,7,9,13-ペンタメチル-16-[(E)-1-メチル-2-(2-メチル-4-チアゾリル)エテニル]-1-オキサシクロヘキサデカ-10,13-ジエン-2,6-ジオン
(4S,7R,8S,9S,10E,13Z,16S)-4,8-ジヒドロキシ-5,5,7,9,13-ペンタメチル-16-[(E)-1-メチル-2-(2-メチル-4-チアゾリル)エテニル]-1-オキサシクロヘキサデカン-10,13-ジエン-2,6-ジオン
(4S,7R,8S,9S,10E,13Z,16S)-4,8-ジヒドロキシ-5,5,7,9,13-ペンタメチル-16-[(1E)-1-(2-メチル-1,3-チアゾール-4-イル)プロパ-1-エン-2-イル]-1-オキサシクロヘキサデカ-10,13-ジエン-2,6-ジオン
(4S,7R,8S,9S,10E,13Z,16S)-4,8-dihydroxy-5,5,7,9,13-pentamethyl-16-[(1E)-1-(2-methyl-1,3-thiazol-4-yl)prop-1-en-2-yl]-1-oxacyclohexadeca-10,13-diene-2,6-dione
Other name (7):
(4S,10E,13Z)-4α,8β-Dihydroxy-5,5,7α,9β,13-pentamethyl-16β-[(E)-1-methyl-2-(2-methyl-4-thiazolyl)ethenyl]-1-oxacyclohexadecane-10,13-diene-2,6-dione
9,10-trans-ジデヒドロエポチロンD
9,10-trans-Didehydroepothilone D
(4S,7R,8S,9S,10E,13Z,16S)-4,8-Dihydroxy-5,5,7,9,13-pentamethyl-16-[(E)-1-methyl-2-(2-methyl-4-thiazolyl)ethenyl]-1-oxacyclohexadeca-10,13-diene-2,6-dione
(E)-9,10-デヒドロ-12,13-デオキシエポチロンB
(E)-9,10-Dehydro-12,13-deoxyepothilone B
(4S,7R,8S,9S,10E,13Z,16S)-4,8-Dihydroxy-5,5,7,9,13-pentamethyl-16-[(E)-1-methyl-2-(2-methyl-4-thiazolyl)ethenyl]-1-oxacyclohexadecane-10,13-diene-2,6-dione
Show all
CAS registry number:
350493-61-7
Thsaurus map:
Return to Previous Page