OMTRIPTOLIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H28O9
Molecular Weight	460.4737
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12C[C@@]3([H])C4=C(CC[C@]3(C)[C@]56O[C@@]5([H])[C@]7([H])O[C@]7(C(C)C)[C@@H](OC(=O)CCC(O)=O)[C@]16O2)C(=O)OC4

InChI

InChIKey=HROMYAWHLUOUPY-AHCCQAQQSA-N

InChI=1S/C24H28O9/c1-10(2)22-17(32-22)18-24(33-18)21(3)7-6-11-12(9-29-19(11)28)13(21)8-14-23(24,31-14)20(22)30-16(27)5-4-15(25)26/h10,13-14,17-18,20H,4-9H2,1-3H3,(H,25,26)/t13-,14-,17-,18-,20+,21-,22-,23+,24+/m0/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

OMTRIPTOLIDE

Official Name

English

4-(((3BS,4AS,5AR,6R,6AS,7AS,7BS,8AS,8BS)-6A-ISOPROPYL-8B-METHYL-1-OXO-1,3,3B,4,4A,6,6A,7A,7B,8B,9,10-DODECAHYDROTRISOXIRENO(6,7:8A,9:4B,5)PHENANTHRO(1,2-C)FURAN-6-YL)OXY)-4-OXOBUTANOIC ACID

Common Name

English

Omtriptolide [WHO-DD]

Common Name

English

omtriptolide [INN]

Common Name

English

PG-490-88

Code

English

BUTANEDIOIC ACID, MONO((3BS,4AS,5AR,6R,6AS,7AS,7BS,8AS,8BS)-1,3,3B,4,4A,6,6A,7A,7B,8B,9,10-DODECAHYDRO-8B-METHYL-6A-(1-METHYLETHYL)-1-OXOTRISOXIRENO(6,7:8A,9:4B,5)PHENANTHRO(1,2-C)FURAN-6-YL) ESTER

Common Name

English

PG490-88

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C574